[3-[(2-cyanophenyl)amino]-3-oxidanylidene-propyl] (E)-3-(3-methoxy-4-oxidanyl-phenyl)prop-2-enoate

Systemtic Name: [3-[(2-cyanophenyl)amino]-3-oxidanylidene-propyl] (E)-3-(3-methoxy-4-oxidanyl-phenyl)prop-2-enoate Openeye Name: [3-(2-cyanoanilino)-3-oxo-propyl] (E)-3-(4-hydroxy-3-methoxy-phenyl)prop-2-enoate CAS Name: (E)-3-(4-hydroxy-3-methoxyphenyl)-2-propenoic acid [3-(2-cyanoanilino)-3-oxopropyl] ester IUPAC Name: [3-(2-cyanoanilino)-3-oxopropyl] (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate Traditional Name: (E)-3-(4-hydroxy-3-methoxy-phenyl)acrylic acid [3-(2-cyanoanilino)-3-keto-propyl] ester Formula: C20H18N2O5 MolecularWeight: 366.36732

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=CC(=O)OCCC(=O)NC2=CC=CC=C2C#N)O

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C/C(=O)OCCC(=O)NC2=CC=CC=C2C#N)O

InChI

InChI=1S/C20H18N2O5/c1-26-18-12-14(6-8-17(18)23)7-9-20(25)27-11-10-19(24)22-16-5-3-2-4-15(16)13-21/h2-9,12,23H,10-11H2,1H3,(H,22,24)/b9-7+