2-[(2-azanyl-4-oxidanyl-4-oxidanylidene-butanoyl)-(phenylmethyl)amino]-3-methyl-butanoic acid

Systemtic Name: 2-[(2-azanyl-4-oxidanyl-4-oxidanylidene-butanoyl)-(phenylmethyl)amino]-3-methyl-butanoic acid Openeye Name: 2-[(2-amino-4-hydroxy-4-oxo-butanoyl)-benzyl-amino]-3-methyl-butanoic acid CAS Name: 2-[(2-amino-4-hydroxy-1,4-dioxobutyl)-(phenylmethyl)amino]-3-methylbutanoic acid IUPAC Name: 2-[(2-amino-4-hydroxy-4-oxobutanoyl)-benzylamino]-3-methylbutanoic acid Traditional Name: 2-[(2-amino-4-hydroxy-4-keto-butanoyl)-benzyl-amino]-3-methyl-butyric acid Formula: C16H22N2O5 MolecularWeight: 322.35628

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22N2O5/c1-10(2)14(16(22)23)18(9-11-6-4-3-5-7-11)15(21)12(17)8-13(19)20/h3-7,10,12,14H,8-9,17H2,1-2H3,(H,19,20)(H,22,23)