(2S)-2-[[(E)-3-(4-chlorophenyl)prop-2-enoyl]amino]-3-methyl-butanoate

Systemtic Name: (2S)-2-[[(E)-3-(4-chlorophenyl)prop-2-enoyl]amino]-3-methyl-butanoate Openeye Name: (2S)-2-[[(E)-3-(4-chlorophenyl)prop-2-enoyl]amino]-3-methyl-butanoate CAS Name: (2S)-2-[[(E)-3-(4-chlorophenyl)-1-oxoprop-2-enyl]amino]-3-methylbutanoate IUPAC Name: (2S)-2-[[(E)-3-(4-chlorophenyl)prop-2-enoyl]amino]-3-methylbutanoate Traditional Name: (2S)-2-[[(E)-3-(4-chlorophenyl)acryloyl]amino]-3-methyl-butyrate Formula: C14H15ClNO3- MolecularWeight: 280.7268

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)[O-])NC(=O)C=CC1=CC=C(C=C1)Cl

Isomeric SMILES

CC(C)[C@@H](C(=O)[O-])NC(=O)/C=C/C1=CC=C(C=C1)Cl

InChI

InChI=1S/C14H16ClNO3/c1-9(2)13(14(18)19)16-12(17)8-5-10-3-6-11(15)7-4-10/h3-9,13H,1-2H3,(H,16,17)(H,18,19)/p-1/b8-5+/t13-/m0/s1