2-[[3-methyl-2-[(2-oxidanylidene-2-phenylmethoxy-ethanoyl)amino]butanoyl]amino]butanedioic acid

Systemtic Name: 2-[[3-methyl-2-[(2-oxidanylidene-2-phenylmethoxy-ethanoyl)amino]butanoyl]amino]butanedioic acid Openeye Name: 2-[[2-[(2-benzyloxy-2-oxo-acetyl)amino]-3-methyl-butanoyl]amino]butanedioic acid CAS Name: 2-[[2-[(1,2-dioxo-2-phenylmethoxyethyl)amino]-3-methyl-1-oxobutyl]amino]butanedioic acid IUPAC Name: 2-[[3-methyl-2-[(2-oxo-2-phenylmethoxyacetyl)amino]butanoyl]amino]butanedioic acid Traditional Name: 2-[[2-[(2-benzoxy-2-keto-acetyl)amino]-3-methyl-butanoyl]amino]succinic acid Formula: C18H22N2O8 MolecularWeight: 394.37588

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC(CC(=O)O)C(=O)O)NC(=O)C(=O)OCC1=CC=CC=C1

Isomeric SMILES

CC(C)C(C(=O)NC(CC(=O)O)C(=O)O)NC(=O)C(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C18H22N2O8/c1-10(2)14(15(23)19-12(17(25)26)8-13(21)22)20-16(24)18(27)28-9-11-6-4-3-5-7-11/h3-7,10,12,14H,8-9H2,1-2H3,(H,19,23)(H,20,24)(H,21,22)(H,25,26)