(3R,4S)-N-[(4-methoxyphenyl)methyl]-3-nitro-nonan-4-amine

Systemtic Name: (3R,4S)-N-[(4-methoxyphenyl)methyl]-3-nitro-nonan-4-amine Openeye Name: (3R,4S)-N-[(4-methoxyphenyl)methyl]-3-nitro-nonan-4-amine CAS Name: (3R,4S)-N-[(4-methoxyphenyl)methyl]-3-nitro-4-nonanamine IUPAC Name: (3R,4S)-N-[(4-methoxyphenyl)methyl]-3-nitrononan-4-amine Traditional Name: [(1S)-1-[(1R)-1-nitropropyl]hexyl]-p-anisyl-amine Formula: C17H28N2O3 MolecularWeight: 308.41582

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C(CC)[N+](=O)[O-])NCC1=CC=C(C=C1)OC

Isomeric SMILES

CCCCC[C@@H]([C@@H](CC)[N+](=O)[O-])NCC1=CC=C(C=C1)OC

InChI

InChI=1S/C17H28N2O3/c1-4-6-7-8-16(17(5-2)19(20)21)18-13-14-9-11-15(22-3)12-10-14/h9-12,16-18H,4-8,13H2,1-3H3/t16-,17+/m0/s1