[1-[(2-methylphenyl)amino]-1-oxidanylidene-propan-2-yl] (E)-3-(1,3-benzodioxol-5-yl)prop-2-enoate

Systemtic Name: [1-[(2-methylphenyl)amino]-1-oxidanylidene-propan-2-yl] (E)-3-(1,3-benzodioxol-5-yl)prop-2-enoate Openeye Name: [1-methyl-2-(2-methylanilino)-2-oxo-ethyl] (E)-3-(1,3-benzodioxol-5-yl)prop-2-enoate CAS Name: (E)-3-(1,3-benzodioxol-5-yl)-2-propenoic acid [1-(2-methylanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(2-methylanilino)-1-oxopropan-2-yl] (E)-3-(1,3-benzodioxol-5-yl)prop-2-enoate Traditional Name: (E)-3-(1,3-benzodioxol-5-yl)acrylic acid [2-keto-1-methyl-2-(o-toluidino)ethyl] ester Formula: C20H19NO5 MolecularWeight: 353.36856

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)C(C)OC(=O)C=CC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC1=CC=CC=C1NC(=O)C(C)OC(=O)/C=C/C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C20H19NO5/c1-13-5-3-4-6-16(13)21-20(23)14(2)26-19(22)10-8-15-7-9-17-18(11-15)25-12-24-17/h3-11,14H,12H2,1-2H3,(H,21,23)/b10-8+