2-[[(E)-3-(4-cyanophenyl)prop-2-enoyl]amino]-3,3-dimethyl-butanoic acid

Systemtic Name: 2-[[(E)-3-(4-cyanophenyl)prop-2-enoyl]amino]-3,3-dimethyl-butanoic acid Openeye Name: 2-[[(E)-3-(4-cyanophenyl)prop-2-enoyl]amino]-3,3-dimethyl-butanoic acid CAS Name: 2-[[(E)-3-(4-cyanophenyl)-1-oxoprop-2-enyl]amino]-3,3-dimethylbutanoic acid IUPAC Name: 2-[[(E)-3-(4-cyanophenyl)prop-2-enoyl]amino]-3,3-dimethylbutanoic acid Traditional Name: 2-[[(E)-3-(4-cyanophenyl)acryloyl]amino]-3,3-dimethyl-butyric acid Formula: C16H18N2O3 MolecularWeight: 286.32572

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18N2O3/c1-16(2,3)14(15(20)21)18-13(19)9-8-11-4-6-12(10-17)7-5-11/h4-9,14H,1-3H3,(H,18,19)(H,20,21)/b9-8+