[3-[(E)-3-[(3-chloranyl-2-methyl-phenyl)amino]-2-cyano-3-oxidanylidene-prop-1-enyl]phenyl] cyclohexanecarboxylate

Systemtic Name: [3-[(E)-3-[(3-chloranyl-2-methyl-phenyl)amino]-2-cyano-3-oxidanylidene-prop-1-enyl]phenyl] cyclohexanecarboxylate Openeye Name: [3-[(E)-3-(3-chloro-2-methyl-anilino)-2-cyano-3-oxo-prop-1-enyl]phenyl] cyclohexanecarboxylate CAS Name: cyclohexanecarboxylic acid [3-[(E)-3-(3-chloro-2-methylanilino)-2-cyano-3-oxoprop-1-enyl]phenyl] ester IUPAC Name: [3-[(E)-3-(3-chloro-2-methylanilino)-2-cyano-3-oxoprop-1-enyl]phenyl] cyclohexanecarboxylate Traditional Name: cyclohexanecarboxylic acid [3-[(E)-3-(3-chloro-2-methyl-anilino)-2-cyano-3-keto-prop-1-enyl]phenyl] ester Formula: C24H23ClN2O3 MolecularWeight: 422.90402

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=O)C(=CC2=CC(=CC=C2)OC(=O)C3CCCCC3)C#N

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=O)/C(=C/C2=CC(=CC=C2)OC(=O)C3CCCCC3)/C#N

InChI

InChI=1S/C24H23ClN2O3/c1-16-21(25)11-6-12-22(16)27-23(28)19(15-26)13-17-7-5-10-20(14-17)30-24(29)18-8-3-2-4-9-18/h5-7,10-14,18H,2-4,8-9H2,1H3,(H,27,28)/b19-13+