methyl (E)-3-(methylamino)-2-(4-methylphenyl)carbonyl-but-2-enoate

Systemtic Name: methyl (E)-3-(methylamino)-2-(4-methylphenyl)carbonyl-but-2-enoate Openeye Name: methyl (E)-3-(methylamino)-2-(4-methylbenzoyl)but-2-enoate CAS Name: (E)-3-(methylamino)-2-[(4-methylphenyl)-oxomethyl]-2-butenoic acid methyl ester IUPAC Name: methyl (E)-3-(methylamino)-2-(4-methylbenzoyl)but-2-enoate Traditional Name: (E)-3-(methylamino)-2-p-toluoyl-but-2-enoic acid methyl ester Formula: C14H17NO3 MolecularWeight: 247.28968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C(=C(C)NC)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)/C(=C(/C)\NC)/C(=O)OC

InChI

InChI=1S/C14H17NO3/c1-9-5-7-11(8-6-9)13(16)12(10(2)15-3)14(17)18-4/h5-8,15H,1-4H3/b12-10+