3-methyl-2-[[4-(4-oxidanylidenepiperidin-1-yl)phenyl]carbonylamino]butanoic acid

Systemtic Name: 3-methyl-2-[[4-(4-oxidanylidenepiperidin-1-yl)phenyl]carbonylamino]butanoic acid Openeye Name: 3-methyl-2-[[4-(4-oxo-1-piperidyl)benzoyl]amino]butanoic acid CAS Name: 3-methyl-2-[[oxo-[4-(4-oxo-1-piperidinyl)phenyl]methyl]amino]butanoic acid IUPAC Name: 3-methyl-2-[[4-(4-oxopiperidin-1-yl)benzoyl]amino]butanoic acid Traditional Name: 2-[[4-(4-ketopiperidino)benzoyl]amino]-3-methyl-butyric acid Formula: C17H22N2O4 MolecularWeight: 318.36758

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NC(=O)C1=CC=C(C=C1)N2CCC(=O)CC2

Isomeric SMILES

CC(C)C(C(=O)O)NC(=O)C1=CC=C(C=C1)N2CCC(=O)CC2

InChI

InChI=1S/C17H22N2O4/c1-11(2)15(17(22)23)18-16(21)12-3-5-13(6-4-12)19-9-7-14(20)8-10-19/h3-6,11,15H,7-10H2,1-2H3,(H,18,21)(H,22,23)