(2S,3S)-2-azanyl-N-(1-diphenoxyphosphorylbutyl)-3-methyl-pentanamide

Systemtic Name: (2S,3S)-2-azanyl-N-(1-diphenoxyphosphorylbutyl)-3-methyl-pentanamide Openeye Name: (2S,3S)-2-amino-N-(1-diphenoxyphosphorylbutyl)-3-methyl-pentanamide CAS Name: (2S,3S)-2-amino-N-(1-diphenoxyphosphorylbutyl)-3-methylpentanamide IUPAC Name: (2S,3S)-2-amino-N-(1-diphenoxyphosphorylbutyl)-3-methylpentanamide Traditional Name: (2S,3S)-2-amino-N-(1-diphenoxyphosphorylbutyl)-3-methyl-valeramide Formula: C22H31N2O4P MolecularWeight: 418.466301

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(NC(=O)C(C(C)CC)N)P(=O)(OC1=CC=CC=C1)OC2=CC=CC=C2

Isomeric SMILES

CCCC(NC(=O)[C@H]([C@@H](C)CC)N)P(=O)(OC1=CC=CC=C1)OC2=CC=CC=C2

InChI

InChI=1S/C22H31N2O4P/c1-4-12-20(24-22(25)21(23)17(3)5-2)29(26,27-18-13-8-6-9-14-18)28-19-15-10-7-11-16-19/h6-11,13-17,20-21H,4-5,12,23H2,1-3H3,(H,24,25)/t17-,20?,21-/m0/s1