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Details

Stereochemistry ABSOLUTE
Molecular Formula C26H40N4.3ClH
Molecular Weight 518.005
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of MCOPPB TRIHYDROCHLORIDE

SMILES

Cl.Cl.Cl.CC1(CCCCCCC1)N2CCC(CC2)N3C(=NC4=CC=CC=C34)[C@@H]5CCCNC5

InChI

InChIKey=DTIPEVOPCGEULQ-RFCADEKQSA-N
InChI=1S/C26H40N4.3ClH/c1-26(15-7-3-2-4-8-16-26)29-18-13-22(14-19-29)30-24-12-6-5-11-23(24)28-25(30)21-10-9-17-27-20-21;;;/h5-6,11-12,21-22,27H,2-4,7-10,13-20H2,1H3;3*1H/t21-;;;/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 C26H40N4
Molecular Weight 408.6226
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 15:40:04 UTC 2023
Edited
by admin
on Sat Dec 16 15:40:04 UTC 2023
Record UNII
SIO8DBP4K7
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
MCOPPB TRIHYDROCHLORIDE
Common Name English
1H-BENZIMIDAZOLE, 1-(1-(1-METHYLCYCLOOCTYL)-4-PIPERIDINYL)-2-(3R)-3-PIPERIDINYL-, HYDROCHLORIDE (1:3)
Systematic Name English
Code System Code Type Description
PUBCHEM
25208093
Created by admin on Sat Dec 16 15:40:04 UTC 2023 , Edited by admin on Sat Dec 16 15:40:04 UTC 2023
PRIMARY
CAS
1108147-88-1
Created by admin on Sat Dec 16 15:40:04 UTC 2023 , Edited by admin on Sat Dec 16 15:40:04 UTC 2023
PRIMARY
FDA UNII
SIO8DBP4K7
Created by admin on Sat Dec 16 15:40:04 UTC 2023 , Edited by admin on Sat Dec 16 15:40:04 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE
Related Record Type Details
ACTIVE MOIETY