(3R,4S)-N-diphenylphosphoryl-2,2-dimethyl-4-nitro-hexan-3-amine

Systemtic Name: (3R,4S)-N-diphenylphosphoryl-2,2-dimethyl-4-nitro-hexan-3-amine Openeye Name: (3R,4S)-N-diphenylphosphoryl-2,2-dimethyl-4-nitro-hexan-3-amine CAS Name: (3R,4S)-N-diphenylphosphoryl-2,2-dimethyl-4-nitro-3-hexanamine IUPAC Name: (3R,4S)-N-diphenylphosphoryl-2,2-dimethyl-4-nitrohexan-3-amine Traditional Name: [(1R,2S)-1-tert-butyl-2-nitro-butyl]-diphenylphosphoryl-amine Formula: C20H27N2O3P MolecularWeight: 374.413741

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H27N2O3P/c1-5-18(22(23)24)19(20(2,3)4)21-26(25,16-12-8-6-9-13-16)17-14-10-7-11-15-17/h6-15,18-19H,5H2,1-4H3,(H,21,25)/t18-,19-/m0/s1