2-[[(E)-3-(3-cyanophenyl)prop-2-enoyl]amino]-3-methyl-butanoic acid

Systemtic Name: 2-[[(E)-3-(3-cyanophenyl)prop-2-enoyl]amino]-3-methyl-butanoic acid Openeye Name: 2-[[(E)-3-(3-cyanophenyl)prop-2-enoyl]amino]-3-methyl-butanoic acid CAS Name: 2-[[(E)-3-(3-cyanophenyl)-1-oxoprop-2-enyl]amino]-3-methylbutanoic acid IUPAC Name: 2-[[(E)-3-(3-cyanophenyl)prop-2-enoyl]amino]-3-methylbutanoic acid Traditional Name: 2-[[(E)-3-(3-cyanophenyl)acryloyl]amino]-3-methyl-butyric acid Formula: C15H16N2O3 MolecularWeight: 272.29914

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NC(=O)C=CC1=CC=CC(=C1)C#N

Isomeric SMILES

CC(C)C(C(=O)O)NC(=O)/C=C/C1=CC=CC(=C1)C#N

InChI

InChI=1S/C15H16N2O3/c1-10(2)14(15(19)20)17-13(18)7-6-11-4-3-5-12(8-11)9-16/h3-8,10,14H,1-2H3,(H,17,18)(H,19,20)/b7-6+