[2-[(3-ethanoylphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] (E)-3-(1,3-benzodioxol-5-yl)prop-2-enoate

Systemtic Name: [2-[(3-ethanoylphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] (E)-3-(1,3-benzodioxol-5-yl)prop-2-enoate Openeye Name: [2-(3-acetylanilino)-2-oxo-1-phenyl-ethyl] (E)-3-(1,3-benzodioxol-5-yl)prop-2-enoate CAS Name: (E)-3-(1,3-benzodioxol-5-yl)-2-propenoic acid [2-(3-acetylanilino)-2-oxo-1-phenylethyl] ester IUPAC Name: [2-(3-acetylanilino)-2-oxo-1-phenylethyl] (E)-3-(1,3-benzodioxol-5-yl)prop-2-enoate Traditional Name: (E)-3-(1,3-benzodioxol-5-yl)acrylic acid [2-(3-acetylanilino)-2-keto-1-phenyl-ethyl] ester Formula: C26H21NO6 MolecularWeight: 443.44804

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)NC(=O)C(C2=CC=CC=C2)OC(=O)C=CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)NC(=O)C(C2=CC=CC=C2)OC(=O)/C=C/C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C26H21NO6/c1-17(28)20-8-5-9-21(15-20)27-26(30)25(19-6-3-2-4-7-19)33-24(29)13-11-18-10-12-22-23(14-18)32-16-31-22/h2-15,25H,16H2,1H3,(H,27,30)/b13-11+