2-methyl-2-(2-phenylethanoylamino)-4-phosphono-butanoic acid

Systemtic Name: 2-methyl-2-(2-phenylethanoylamino)-4-phosphono-butanoic acid Openeye Name: 2-methyl-2-[(2-phenylacetyl)amino]-4-phosphono-butanoic acid CAS Name: 2-methyl-2-[(1-oxo-2-phenylethyl)amino]-4-phosphonobutanoic acid IUPAC Name: 2-methyl-2-[(2-phenylacetyl)amino]-4-phosphonobutanoic acid Traditional Name: 2-methyl-2-[(2-phenylacetyl)amino]-4-phosphono-butyric acid Formula: C13H18NO6P MolecularWeight: 315.258881

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCP(=O)(O)O)(C(=O)O)NC(=O)CC1=CC=CC=C1

Isomeric SMILES

CC(CCP(=O)(O)O)(C(=O)O)NC(=O)CC1=CC=CC=C1

InChI

InChI=1S/C13H18NO6P/c1-13(12(16)17,7-8-21(18,19)20)14-11(15)9-10-5-3-2-4-6-10/h2-6H,7-9H2,1H3,(H,14,15)(H,16,17)(H2,18,19,20)