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

Systemtic Name: [(2S)-1-[(2-methoxyphenyl)amino]-1-oxidanylidene-propan-2-yl] (E)-3-thiophen-3-ylprop-2-enoate Openeye Name: [(1S)-2-(2-methoxyanilino)-1-methyl-2-oxo-ethyl] (E)-3-(3-thienyl)prop-2-enoate CAS Name: (E)-3-(3-thiophenyl)-2-propenoic acid [(2S)-1-(2-methoxyanilino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(2-methoxyanilino)-1-oxopropan-2-yl] (E)-3-thiophen-3-ylprop-2-enoate Traditional Name: (E)-3-(3-thienyl)acrylic acid [(1S)-2-keto-1-methyl-2-(o-anisidino)ethyl] ester Formula: C17H17NO4S MolecularWeight: 331.38618

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1OC)OC(=O)C=CC2=CSC=C2

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=CC=C1OC)OC(=O)/C=C/C2=CSC=C2

InChI

InChI=1S/C17H17NO4S/c1-12(22-16(19)8-7-13-9-10-23-11-13)17(20)18-14-5-3-4-6-15(14)21-2/h3-12H,1-2H3,(H,18,20)/b8-7+/t12-/m0/s1