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

Systemtic Name: [4-[2-cyano-3-oxidanylidene-3-(prop-2-enylamino)prop-1-enyl]-2-methoxy-phenyl] 3-(3,4-dimethoxyphenyl)prop-2-enoate Openeye Name: [4-[3-(allylamino)-2-cyano-3-oxo-prop-1-enyl]-2-methoxy-phenyl] 3-(3,4-dimethoxyphenyl)prop-2-enoate CAS Name: 3-(3,4-dimethoxyphenyl)-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-(3,4-dimethoxyphenyl)prop-2-enoate Traditional Name: 3-(3,4-dimethoxyphenyl)acrylic acid [4-[3-(allylamino)-2-cyano-3-keto-prop-1-enyl]-2-methoxy-phenyl] ester Formula: C25H24N2O6 MolecularWeight: 448.46786

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CC(=O)OC2=C(C=C(C=C2)C=C(C#N)C(=O)NCC=C)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C=CC(=O)OC2=C(C=C(C=C2)C=C(C#N)C(=O)NCC=C)OC)OC

InChI

InChI=1S/C25H24N2O6/c1-5-12-27-25(29)19(16-26)13-18-7-10-21(23(15-18)32-4)33-24(28)11-8-17-6-9-20(30-2)22(14-17)31-3/h5-11,13-15H,1,12H2,2-4H3,(H,27,29)