sodium acetamidomethyl-[[1-[(4-methyl-1-oxidanyl-1-oxidanylidene-pentan-2-yl)amino]-2-phenyl-ethyl]amino]phosphinate

Systemtic Name: sodium acetamidomethyl-[[1-[(4-methyl-1-oxidanyl-1-oxidanylidene-pentan-2-yl)amino]-2-phenyl-ethyl]amino]phosphinate Openeye Name: sodium acetamidomethyl-[[1-[(1-carboxy-3-methyl-butyl)amino]-2-phenyl-ethyl]amino]phosphinate CAS Name: sodium acetamidomethyl-[[1-[(1-hydroxy-4-methyl-1-oxopentan-2-yl)amino]-2-phenylethyl]amino]phosphinate IUPAC Name: sodium acetamidomethyl-[[1-[(1-hydroxy-4-methyl-1-oxopentan-2-yl)amino]-2-phenylethyl]amino]phosphinate Traditional Name: sodium acetamidomethyl-[[1-[(1-carboxy-3-methyl-butyl)amino]-2-phenyl-ethyl]amino]phosphinate Formula: C17H27N3NaO5P MolecularWeight: 407.376911

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)NC(CC1=CC=CC=C1)NP(=O)(CNC(=O)C)[O-].[Na+]

Isomeric SMILES

CC(C)CC(C(=O)O)NC(CC1=CC=CC=C1)NP(=O)(CNC(=O)C)[O-].[Na+]

InChI

InChI=1S/C17H28N3O5P.Na/c1-12(2)9-15(17(22)23)19-16(10-14-7-5-4-6-8-14)20-26(24,25)11-18-13(3)21;/h4-8,12,15-16,19H,9-11H2,1-3H3,(H,18,21)(H,22,23)(H2,20,24,25);/q;+1/p-1