[4-[(Z)-2-cyano-3-[(4-ethoxyphenyl)amino]-3-oxidanylidene-prop-1-enyl]-2-ethoxy-phenyl] 2-chloranylbenzoate

Systemtic Name: [4-[(Z)-2-cyano-3-[(4-ethoxyphenyl)amino]-3-oxidanylidene-prop-1-enyl]-2-ethoxy-phenyl] 2-chloranylbenzoate Openeye Name: [4-[(Z)-2-cyano-3-(4-ethoxyanilino)-3-oxo-prop-1-enyl]-2-ethoxy-phenyl] 2-chlorobenzoate CAS Name: 2-chlorobenzoic acid [4-[(Z)-2-cyano-3-(4-ethoxyanilino)-3-oxoprop-1-enyl]-2-ethoxyphenyl] ester IUPAC Name: [4-[(Z)-2-cyano-3-(4-ethoxyanilino)-3-oxoprop-1-enyl]-2-ethoxyphenyl] 2-chlorobenzoate Traditional Name: 2-chlorobenzoic acid [4-[(Z)-2-cyano-3-keto-3-(p-phenetidino)prop-1-enyl]-2-ethoxy-phenyl] ester Formula: C27H23ClN2O5 MolecularWeight: 490.93492

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)C(=CC2=CC(=C(C=C2)OC(=O)C3=CC=CC=C3Cl)OCC)C#N

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)/C(=C\C2=CC(=C(C=C2)OC(=O)C3=CC=CC=C3Cl)OCC)/C#N

InChI

InChI=1S/C27H23ClN2O5/c1-3-33-21-12-10-20(11-13-21)30-26(31)19(17-29)15-18-9-14-24(25(16-18)34-4-2)35-27(32)22-7-5-6-8-23(22)28/h5-16H,3-4H2,1-2H3,(H,30,31)/b19-15-