[2-(4-chlorophenyl)-2-oxidanylidene-ethyl] (E)-2-acetamido-3-(1,3-benzodioxol-5-yl)prop-2-enoate

Systemtic Name: [2-(4-chlorophenyl)-2-oxidanylidene-ethyl] (E)-2-acetamido-3-(1,3-benzodioxol-5-yl)prop-2-enoate Openeye Name: [2-(4-chlorophenyl)-2-oxo-ethyl] (E)-2-acetamido-3-(1,3-benzodioxol-5-yl)prop-2-enoate CAS Name: (E)-2-acetamido-3-(1,3-benzodioxol-5-yl)-2-propenoic acid [2-(4-chlorophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-chlorophenyl)-2-oxoethyl] (E)-2-acetamido-3-(1,3-benzodioxol-5-yl)prop-2-enoate Traditional Name: (E)-2-acetamido-3-(1,3-benzodioxol-5-yl)acrylic acid [2-(4-chlorophenyl)-2-keto-ethyl] ester Formula: C20H16ClNO6 MolecularWeight: 401.79714

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(=CC1=CC2=C(C=C1)OCO2)C(=O)OCC(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC(=O)N/C(=C/C1=CC2=C(C=C1)OCO2)/C(=O)OCC(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H16ClNO6/c1-12(23)22-16(8-13-2-7-18-19(9-13)28-11-27-18)20(25)26-10-17(24)14-3-5-15(21)6-4-14/h2-9H,10-11H2,1H3,(H,22,23)/b16-8+