(1R,2S)-N-diphenylphosphoryl-1-(4-methoxyphenyl)-2-nitro-butan-1-amine

Systemtic Name: (1R,2S)-N-diphenylphosphoryl-1-(4-methoxyphenyl)-2-nitro-butan-1-amine Openeye Name: (1R,2S)-N-diphenylphosphoryl-1-(4-methoxyphenyl)-2-nitro-butan-1-amine CAS Name: (1R,2S)-N-diphenylphosphoryl-1-(4-methoxyphenyl)-2-nitro-1-butanamine IUPAC Name: (1R,2S)-N-diphenylphosphoryl-1-(4-methoxyphenyl)-2-nitrobutan-1-amine Traditional Name: diphenylphosphoryl-[(1R,2S)-1-(4-methoxyphenyl)-2-nitro-butyl]amine Formula: C23H25N2O4P MolecularWeight: 424.429361

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H25N2O4P/c1-3-22(25(26)27)23(18-14-16-19(29-2)17-15-18)24-30(28,20-10-6-4-7-11-20)21-12-8-5-9-13-21/h4-17,22-23H,3H2,1-2H3,(H,24,28)/t22-,23+/m0/s1