2-(1-azanyl-2-oxidanyl-2-oxidanylidene-ethyl)-3-[(phenylmethyl)carbamoyloxymethyl]cyclopropane-1-carboxylic acid

Systemtic Name: 2-(1-azanyl-2-oxidanyl-2-oxidanylidene-ethyl)-3-[(phenylmethyl)carbamoyloxymethyl]cyclopropane-1-carboxylic acid Openeye Name: 2-(1-amino-2-hydroxy-2-oxo-ethyl)-3-(benzylcarbamoyloxymethyl)cyclopropanecarboxylic acid CAS Name: 2-(1-amino-2-hydroxy-2-oxoethyl)-3-[[oxo-[(phenylmethyl)amino]methoxy]methyl]-1-cyclopropanecarboxylic acid IUPAC Name: 2-(1-amino-2-hydroxy-2-oxoethyl)-3-(benzylcarbamoyloxymethyl)cyclopropane-1-carboxylic acid Traditional Name: 2-(1-amino-2-hydroxy-2-keto-ethyl)-3-(benzylcarbamoyloxymethyl)cyclopropanecarboxylic acid Formula: C15H18N2O6 MolecularWeight: 322.31322

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)OCC2C(C2C(=O)O)C(C(=O)O)N

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)OCC2C(C2C(=O)O)C(C(=O)O)N

InChI

InChI=1S/C15H18N2O6/c16-12(14(20)21)10-9(11(10)13(18)19)7-23-15(22)17-6-8-4-2-1-3-5-8/h1-5,9-12H,6-7,16H2,(H,17,22)(H,18,19)(H,20,21)