(E)-3-[(4-cyanophenyl)carbonylamino]-2,2-dimethyl-hex-4-enoic acid

Systemtic Name: (E)-3-[(4-cyanophenyl)carbonylamino]-2,2-dimethyl-hex-4-enoic acid Openeye Name: (E)-3-[(4-cyanobenzoyl)amino]-2,2-dimethyl-hex-4-enoic acid CAS Name: (E)-3-[[(4-cyanophenyl)-oxomethyl]amino]-2,2-dimethyl-4-hexenoic acid IUPAC Name: (E)-3-[(4-cyanobenzoyl)amino]-2,2-dimethylhex-4-enoic acid Traditional Name: (E)-3-[(4-cyanobenzoyl)amino]-2,2-dimethyl-hex-4-enoic acid Formula: C16H18N2O3 MolecularWeight: 286.32572

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18N2O3/c1-4-5-13(16(2,3)15(20)21)18-14(19)12-8-6-11(10-17)7-9-12/h4-9,13H,1-3H3,(H,18,19)(H,20,21)/b5-4+