4-[(4-methyl-1-oxidanylidene-1-phenylazanyl-pentan-2-yl)amino]-2,3-bis(oxidanyl)-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[(4-methyl-1-oxidanylidene-1-phenylazanyl-pentan-2-yl)amino]-2,3-bis(oxidanyl)-4-oxidanylidene-butanoic acid Openeye Name: 2,3-dihydroxy-4-[[3-methyl-1-(phenylcarbamoyl)butyl]amino]-4-oxo-butanoic acid CAS Name: 4-[(1-anilino-4-methyl-1-oxopentan-2-yl)amino]-2,3-dihydroxy-4-oxobutanoic acid IUPAC Name: 4-[(1-anilino-4-methyl-1-oxopentan-2-yl)amino]-2,3-dihydroxy-4-oxobutanoic acid Traditional Name: 2,3-dihydroxy-4-keto-4-[[3-methyl-1-(phenylcarbamoyl)butyl]amino]butyric acid Formula: C16H22N2O6 MolecularWeight: 338.35568

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC1=CC=CC=C1)NC(=O)C(C(C(=O)O)O)O

Isomeric SMILES

CC(C)CC(C(=O)NC1=CC=CC=C1)NC(=O)C(C(C(=O)O)O)O

InChI

InChI=1S/C16H22N2O6/c1-9(2)8-11(14(21)17-10-6-4-3-5-7-10)18-15(22)12(19)13(20)16(23)24/h3-7,9,11-13,19-20H,8H2,1-2H3,(H,17,21)(H,18,22)(H,23,24)