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Details

Stereochemistry ABSOLUTE
Molecular Formula C17H18ClNO.C4H4O4
Molecular Weight 403.856
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of SCH-23390 MALEATE

SMILES

OC(=O)\C=C/C(O)=O.CN1CCC2=CC(Cl)=C(O)C=C2[C@H](C1)C3=CC=CC=C3

InChI

InChIKey=FGHVSEXHEAUJBT-HFNHQGOYSA-N
InChI=1S/C17H18ClNO.C4H4O4/c1-19-8-7-13-9-16(18)17(20)10-14(13)15(11-19)12-5-3-2-4-6-12;5-3(6)1-2-4(7)8/h2-6,9-10,15,20H,7-8,11H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1-/t15-;/m1./s1

HIDE SMILES / InChI

Approval Year

Name Type Language
SCH-23390 MALEATE
Common Name English
1H-3-BENZAZEPIN-7-OL, 8-CHLORO-2,3,4,5-TETRAHYDRO-3-METHYL-5-PHENYL-, (R)-, (Z)-2-BUTENEDIOATE (1:1) (SALT)
Common Name English
1H-3-BENZAZEPIN-7-OL, 8-CHLORO-2,3,4,5-TETRAHYDRO-3-METHYL-5-PHENYL-, (5R)-, (2Z)-2-BUTENEDIOATE (1:1)
Systematic Name English
1H-3-BENZAZEPIN-7-OL, 8-CHLORO-2,3,4,5-TETRAHYDRO-3-METHYL-5-PHENYL-, (5R)-, (2Z)-2-BUTENEDIOATE (1:1) (SALT)
Common Name English
Code System Code Type Description
FDA UNII
3T51J24N1F
Created by admin on Fri Dec 15 16:46:10 UTC 2023 , Edited by admin on Fri Dec 15 16:46:10 UTC 2023
PRIMARY
CAS
87134-87-0
Created by admin on Fri Dec 15 16:46:10 UTC 2023 , Edited by admin on Fri Dec 15 16:46:10 UTC 2023
PRIMARY
PUBCHEM
6440792
Created by admin on Fri Dec 15 16:46:10 UTC 2023 , Edited by admin on Fri Dec 15 16:46:10 UTC 2023
PRIMARY