2-azanyl-2,5-dimethyl-4-[(4-methylphenyl)carbonylamino]-3-oxidanylidene-hexanoic acid

Systemtic Name: 2-azanyl-2,5-dimethyl-4-[(4-methylphenyl)carbonylamino]-3-oxidanylidene-hexanoic acid Openeye Name: 2-amino-2,5-dimethyl-4-[(4-methylbenzoyl)amino]-3-oxo-hexanoic acid CAS Name: 2-amino-2,5-dimethyl-4-[[(4-methylphenyl)-oxomethyl]amino]-3-oxohexanoic acid IUPAC Name: 2-amino-2,5-dimethyl-4-[(4-methylbenzoyl)amino]-3-oxohexanoic acid Traditional Name: 2-amino-3-keto-2,5-dimethyl-4-(p-toluoylamino)hexanoic acid Formula: C16H22N2O4 MolecularWeight: 306.35688

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22N2O4/c1-9(2)12(13(19)16(4,17)15(21)22)18-14(20)11-7-5-10(3)6-8-11/h5-9,12H,17H2,1-4H3,(H,18,20)(H,21,22)