3-[(4-cyanophenyl)carbonylamino]-2,2-dimethyl-heptanoic acid

Systemtic Name: 3-[(4-cyanophenyl)carbonylamino]-2,2-dimethyl-heptanoic acid Openeye Name: 3-[(4-cyanobenzoyl)amino]-2,2-dimethyl-heptanoic acid CAS Name: 3-[[(4-cyanophenyl)-oxomethyl]amino]-2,2-dimethylheptanoic acid IUPAC Name: 3-[(4-cyanobenzoyl)amino]-2,2-dimethylheptanoic acid Traditional Name: 3-[(4-cyanobenzoyl)amino]-2,2-dimethyl-enanthic acid Formula: C17H22N2O3 MolecularWeight: 302.36818

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H22N2O3/c1-4-5-6-14(17(2,3)16(21)22)19-15(20)13-9-7-12(11-18)8-10-13/h7-10,14H,4-6H2,1-3H3,(H,19,20)(H,21,22)