methyl (2S)-4-oxidanylidene-2-[(phenylmethyl)-prop-2-enoyl-amino]butanoate

Systemtic Name: methyl (2S)-4-oxidanylidene-2-[(phenylmethyl)-prop-2-enoyl-amino]butanoate Openeye Name: methyl (2S)-2-[benzyl(prop-2-enoyl)amino]-4-oxo-butanoate CAS Name: (2S)-4-oxo-2-[1-oxoprop-2-enyl-(phenylmethyl)amino]butanoic acid methyl ester IUPAC Name: methyl (2S)-2-[benzyl(prop-2-enoyl)amino]-4-oxobutanoate Traditional Name: (2S)-2-[acryloyl(benzyl)amino]-4-keto-butyric acid methyl ester Formula: C15H17NO4 MolecularWeight: 275.29978

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC=O)N(CC1=CC=CC=C1)C(=O)C=C

Isomeric SMILES

COC(=O)[C@H](CC=O)N(CC1=CC=CC=C1)C(=O)C=C

InChI

InChI=1S/C15H17NO4/c1-3-14(18)16(11-12-7-5-4-6-8-12)13(9-10-17)15(19)20-2/h3-8,10,13H,1,9,11H2,2H3/t13-/m0/s1