2-[[C-methyl-N-(1-oxidanyl-1-oxidanylidene-3-phenyl-propan-2-yl)carbonimidoyl]amino]-3-phenyl-propanoic acid

Systemtic Name: 2-[[C-methyl-N-(1-oxidanyl-1-oxidanylidene-3-phenyl-propan-2-yl)carbonimidoyl]amino]-3-phenyl-propanoic acid Openeye Name: 2-[[N-(1-benzyl-2-hydroxy-2-oxo-ethyl)-C-methyl-carbonimidoyl]amino]-3-phenyl-propanoic acid CAS Name: 2-[1-(1-hydroxy-1-oxo-3-phenylpropan-2-yl)iminoethylamino]-3-phenylpropanoic acid IUPAC Name: 2-[[N-(1-hydroxy-1-oxo-3-phenylpropan-2-yl)-C-methylcarbonimidoyl]amino]-3-phenylpropanoic acid Traditional Name: 2-[[N-(1-benzyl-2-hydroxy-2-keto-ethyl)-C-methyl-carbonimidoyl]amino]-3-phenyl-propionic acid Formula: C20H22N2O4 MolecularWeight: 354.39968

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NC(CC1=CC=CC=C1)C(=O)O)NC(CC2=CC=CC=C2)C(=O)O

Isomeric SMILES

CC(=NC(CC1=CC=CC=C1)C(=O)O)NC(CC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C20H22N2O4/c1-14(21-17(19(23)24)12-15-8-4-2-5-9-15)22-18(20(25)26)13-16-10-6-3-7-11-16/h2-11,17-18H,12-13H2,1H3,(H,21,22)(H,23,24)(H,25,26)