3-[(4-cyanophenyl)carbonylamino]-2,2,5-trimethyl-hexanoic acid

Systemtic Name: 3-[(4-cyanophenyl)carbonylamino]-2,2,5-trimethyl-hexanoic acid Openeye Name: 3-[(4-cyanobenzoyl)amino]-2,2,5-trimethyl-hexanoic acid CAS Name: 3-[[(4-cyanophenyl)-oxomethyl]amino]-2,2,5-trimethylhexanoic acid IUPAC Name: 3-[(4-cyanobenzoyl)amino]-2,2,5-trimethylhexanoic acid Traditional Name: 3-[(4-cyanobenzoyl)amino]-2,2,5-trimethyl-hexanoic acid Formula: C17H22N2O3 MolecularWeight: 302.36818

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H22N2O3/c1-11(2)9-14(17(3,4)16(21)22)19-15(20)13-7-5-12(10-18)6-8-13/h5-8,11,14H,9H2,1-4H3,(H,19,20)(H,21,22)