[1-[(3-methylphenyl)amino]-1-oxidanylidene-propan-2-yl] (E)-3-thiophen-3-ylprop-2-enoate

Systemtic Name: [1-[(3-methylphenyl)amino]-1-oxidanylidene-propan-2-yl] (E)-3-thiophen-3-ylprop-2-enoate Openeye Name: [1-methyl-2-(3-methylanilino)-2-oxo-ethyl] (E)-3-(3-thienyl)prop-2-enoate CAS Name: (E)-3-(3-thiophenyl)-2-propenoic acid [1-(3-methylanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(3-methylanilino)-1-oxopropan-2-yl] (E)-3-thiophen-3-ylprop-2-enoate Traditional Name: (E)-3-(3-thienyl)acrylic acid [2-keto-1-methyl-2-(m-toluidino)ethyl] ester Formula: C17H17NO3S MolecularWeight: 315.38678

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)C(C)OC(=O)C=CC2=CSC=C2

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)C(C)OC(=O)/C=C/C2=CSC=C2

InChI

InChI=1S/C17H17NO3S/c1-12-4-3-5-15(10-12)18-17(20)13(2)21-16(19)7-6-14-8-9-22-11-14/h3-11,13H,1-2H3,(H,18,20)/b7-6+