Watanidipine

CAS Registry Number®

116308-55-5

CAS Name

Watanidipine

Molecular Formula

C41H42N4O6

Molecular Mass

686.80

Cite this Page

Watanidipine.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=116308-55-5 (retrieved 2024-11-25) (CAS RN: 116308-55-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C41H42N4O6/c1-28-36(40(46)50-3)38(33-15-10-16-35(27-33)45(48)49)37(29(2)42-28)41(47)51-26-21-30-17-19-34(20-18-30)43-22-24-44(25-23-43)39(31-11-6-4-7-12-31)32-13-8-5-9-14-32/h4-20,27,38-39,42H,21-26H2,1-3H3

InChIKey

InChIKey=OTTHUQAYARCXLP-UHFFFAOYSA-N

SMILES

C(OCCC1=CC=C(C=C1)N2CCN(C(C3=CC=CC=C3)C4=CC=CC=C4)CC2)(=O)C=5C(C(C(OC)=O)=C(C)NC5C)C6=CC(N(=O)=O)=CC=C6

Canonical SMILES

O=C(OC)C1=C(NC(=C(C(=O)OCCC2=CC=C(C=C2)N3CCN(CC3)C(C=4C=CC=CC4)C=5C=CC=CC5)C1C=6C=CC=C(C6)N(=O)=O)C)C

Other Names for this Substance

  • 3,5-Pyridinedicarboxylic acid, 1,4-dihydro-2,6-dimethyl-4-(3-nitrophenyl)-, 3-[2-[4-[4-(diphenylmethyl)-1-piperazinyl]phenyl]ethyl] 5-methyl ester
  • 3,5-Pyridinedicarboxylic acid, 1,4-dihydro-2,6-dimethyl-4-(3-nitrophenyl)-, 2-[4-[4-(diphenylmethyl)-1-piperazinyl]phenyl]ethyl methyl ester
  • Vatanidipine
  • Watanidipine

Deleted or Replaced CAS Registry Numbers

134054-36-7

CAS INSIGHTSTM
Hourglass and a clock