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Details

Stereochemistry UNKNOWN
Molecular Formula C27H28N2O7
Molecular Weight 492.5215
Optical Activity ( - )
Additional Stereochemistry Yes
Defined Stereocenters 0 / 1
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of CILNIDIPINE, (-)-

SMILES

CC1=C(C(c2cccc(c2)N(=O)=O)C(=C(C)N1)C(=O)OCCOC)C(=O)OC/C(/[H])=C(\[H])/c3ccccc3

InChI

InChIKey=KJEBULYHNRNJTE-DHZHZOJOSA-N
InChI=1S/C27H28N2O7/c1-18-23(26(30)35-14-8-11-20-9-5-4-6-10-20)25(21-12-7-13-22(17-21)29(32)33)24(19(2)28-18)27(31)36-16-15-34-3/h4-13,17,25,28H,14-16H2,1-3H3/b11-8+

HIDE SMILES / InChI

Molecular Formula C27H28N2O7
Molecular Weight 492.5215
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 1
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Sat Jun 26 09:40:59 UTC 2021
Edited
by admin
on Sat Jun 26 09:40:59 UTC 2021
Record UNII
4LNU2SU262
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CILNIDIPINE, (-)-
Common Name English
3,5-PYRIDINEDICARBOXYLIC ACID, 1,4-DIHYDRO-2,6-DIMETHYL-4-(3-NITROPHENYL)-, 2-METHOXYETHYL 3-PHENYL-2-PROPENYL ESTER, (E)-(-)-
Systematic Name English
(-)-FRC-8653
Code English
Code System Code Type Description
CAS
132295-21-7
Created by admin on Sat Jun 26 09:40:59 UTC 2021 , Edited by admin on Sat Jun 26 09:40:59 UTC 2021
PRIMARY
FDA UNII
4LNU2SU262
Created by admin on Sat Jun 26 09:40:59 UTC 2021 , Edited by admin on Sat Jun 26 09:40:59 UTC 2021
PRIMARY
CAS
118934-76-2
Created by admin on Sat Jun 26 09:40:59 UTC 2021 , Edited by admin on Sat Jun 26 09:40:59 UTC 2021
NON-SPECIFIC STEREOCHEMISTRY
Related Record Type Details
RACEMATE -> ENANTIOMER