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Details

Stereochemistry ABSOLUTE
Molecular Formula C35H38N4O6.2ClH
Molecular Weight 683.621
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of MANIDIPINE DIHYDROCHLORIDE, (R)-

SMILES

Cl.Cl.COC(=O)C1=C(C)NC(C)=C([C@@H]1C2=CC=CC(=C2)[N+]([O-])=O)C(=O)OCCN3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChIKey=JINNGBXKBDUGQT-FRNKJVBZSA-N
InChI=1S/C35H38N4O6.2ClH/c1-24-30(34(40)44-3)32(28-15-10-16-29(23-28)39(42)43)31(25(2)36-24)35(41)45-22-21-37-17-19-38(20-18-37)33(26-11-6-4-7-12-26)27-13-8-5-9-14-27;;/h4-16,23,32-33,36H,17-22H2,1-3H3;2*1H/t32-;;/m1../s1

HIDE SMILES / InChI

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C35H38N4O6
Molecular Weight 610.6994
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 10:36:37 UTC 2023
Edited
by admin
on Sat Dec 16 10:36:37 UTC 2023
Record UNII
0GIE8B995I
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
MANIDIPINE DIHYDROCHLORIDE, (R)-
Common Name English
MANIDIPINE DIHYDROCHLORIDE, (-)-
Common Name English
MANIDIPINE HYDROCHLORIDE, (R)-
Common Name English
3,5-PYRIDINEDICARBOXYLIC ACID, 1,4-DIHYDRO-2,6-DIMETHYL-4-(3-NITROPHENYL)-, 2-(4-(DIPHENYLMETHYL)-1-PIPERAZINYL)ETHYL METHYL ESTER, DIHYDROCHLORIDE, (R)-
Systematic Name English
Code System Code Type Description
CAS
126372-04-1
Created by admin on Sat Dec 16 10:36:37 UTC 2023 , Edited by admin on Sat Dec 16 10:36:37 UTC 2023
PRIMARY
FDA UNII
0GIE8B995I
Created by admin on Sat Dec 16 10:36:37 UTC 2023 , Edited by admin on Sat Dec 16 10:36:37 UTC 2023
PRIMARY
PUBCHEM
76968068
Created by admin on Sat Dec 16 10:36:37 UTC 2023 , Edited by admin on Sat Dec 16 10:36:37 UTC 2023
PRIMARY
Related Record Type Details
RACEMATE -> ENANTIOMER