(1R,2S)-N-diphenylphosphoryl-2-nitro-1-phenyl-heptan-1-amine

Systemtic Name: (1R,2S)-N-diphenylphosphoryl-2-nitro-1-phenyl-heptan-1-amine Openeye Name: (1R,2S)-N-diphenylphosphoryl-2-nitro-1-phenyl-heptan-1-amine CAS Name: (1R,2S)-N-diphenylphosphoryl-2-nitro-1-phenyl-1-heptanamine IUPAC Name: (1R,2S)-N-diphenylphosphoryl-2-nitro-1-phenylheptan-1-amine Traditional Name: diphenylphosphoryl-[(1R,2S)-2-nitro-1-phenyl-heptyl]amine Formula: C25H29N2O3P MolecularWeight: 436.483121

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C(C1=CC=CC=C1)NP(=O)(C2=CC=CC=C2)C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCCCC[C@@H]([C@@H](C1=CC=CC=C1)NP(=O)(C2=CC=CC=C2)C3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C25H29N2O3P/c1-2-3-7-20-24(27(28)29)25(21-14-8-4-9-15-21)26-31(30,22-16-10-5-11-17-22)23-18-12-6-13-19-23/h4-6,8-19,24-25H,2-3,7,20H2,1H3,(H,26,30)/t24-,25+/m0/s1