[4-[2-cyano-3-oxidanylidene-3-(prop-2-enylamino)prop-1-enyl]-2-methoxy-phenyl] 3-(4-chlorophenyl)prop-2-enoate

Systemtic Name: [4-[2-cyano-3-oxidanylidene-3-(prop-2-enylamino)prop-1-enyl]-2-methoxy-phenyl] 3-(4-chlorophenyl)prop-2-enoate Openeye Name: [4-[3-(allylamino)-2-cyano-3-oxo-prop-1-enyl]-2-methoxy-phenyl] 3-(4-chlorophenyl)prop-2-enoate CAS Name: 3-(4-chlorophenyl)-2-propenoic acid [4-[2-cyano-3-oxo-3-(prop-2-enylamino)prop-1-enyl]-2-methoxyphenyl] ester IUPAC Name: [4-[2-cyano-3-oxo-3-(prop-2-enylamino)prop-1-enyl]-2-methoxyphenyl] 3-(4-chlorophenyl)prop-2-enoate Traditional Name: 3-(4-chlorophenyl)acrylic acid [4-[3-(allylamino)-2-cyano-3-keto-prop-1-enyl]-2-methoxy-phenyl] ester Formula: C23H19ClN2O4 MolecularWeight: 422.86096

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C(C#N)C(=O)NCC=C)OC(=O)C=CC2=CC=C(C=C2)Cl

Isomeric SMILES

COC1=C(C=CC(=C1)C=C(C#N)C(=O)NCC=C)OC(=O)C=CC2=CC=C(C=C2)Cl

InChI

InChI=1S/C23H19ClN2O4/c1-3-12-26-23(28)18(15-25)13-17-6-10-20(21(14-17)29-2)30-22(27)11-7-16-4-8-19(24)9-5-16/h3-11,13-14H,1,12H2,2H3,(H,26,28)