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

Systemtic Name: 2-(1-azanyl-2-oxidanyl-2-oxidanylidene-ethyl)-3-[[(phenylmethyl)carbamoylamino]methyl]cyclopropane-1-carboxylic acid Openeye Name: 2-(1-amino-2-hydroxy-2-oxo-ethyl)-3-[(benzylcarbamoylamino)methyl]cyclopropanecarboxylic acid CAS Name: 2-(1-amino-2-hydroxy-2-oxoethyl)-3-[[[oxo-[(phenylmethyl)amino]methyl]amino]methyl]-1-cyclopropanecarboxylic acid IUPAC Name: 2-(1-amino-2-hydroxy-2-oxoethyl)-3-[(benzylcarbamoylamino)methyl]cyclopropane-1-carboxylic acid Traditional Name: 2-(1-amino-2-hydroxy-2-keto-ethyl)-3-[(benzylcarbamoylamino)methyl]cyclopropanecarboxylic acid Formula: C15H19N3O5 MolecularWeight: 321.32846

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)NCC2C(C2C(=O)O)C(C(=O)O)N

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)NCC2C(C2C(=O)O)C(C(=O)O)N

InChI

InChI=1S/C15H19N3O5/c16-12(14(21)22)10-9(11(10)13(19)20)7-18-15(23)17-6-8-4-2-1-3-5-8/h1-5,9-12H,6-7,16H2,(H,19,20)(H,21,22)(H2,17,18,23)