[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl] (E)-3-(3-methoxy-4-propoxy-phenyl)prop-2-enoate

Systemtic Name: [2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl] (E)-3-(3-methoxy-4-propoxy-phenyl)prop-2-enoate Openeye Name: [2-(4-methylanilino)-2-oxo-ethyl] (E)-3-(3-methoxy-4-propoxy-phenyl)prop-2-enoate CAS Name: (E)-3-(3-methoxy-4-propoxyphenyl)-2-propenoic acid [2-(4-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-methylanilino)-2-oxoethyl] (E)-3-(3-methoxy-4-propoxyphenyl)prop-2-enoate Traditional Name: (E)-3-(3-methoxy-4-propoxy-phenyl)acrylic acid [2-keto-2-(p-toluidino)ethyl] ester Formula: C22H25NO5 MolecularWeight: 383.4376

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C=CC(=O)OCC(=O)NC2=CC=C(C=C2)C)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)/C=C/C(=O)OCC(=O)NC2=CC=C(C=C2)C)OC

InChI

InChI=1S/C22H25NO5/c1-4-13-27-19-11-7-17(14-20(19)26-3)8-12-22(25)28-15-21(24)23-18-9-5-16(2)6-10-18/h5-12,14H,4,13,15H2,1-3H3,(H,23,24)/b12-8+