4-methoxy-N-[(1S,2R)-2-nitro-1-phenyl-butyl]aniline

Systemtic Name: 4-methoxy-N-[(1S,2R)-2-nitro-1-phenyl-butyl]aniline Openeye Name: 4-methoxy-N-[(1S,2R)-2-nitro-1-phenyl-butyl]aniline CAS Name: 4-methoxy-N-[(1S,2R)-2-nitro-1-phenylbutyl]aniline IUPAC Name: 4-methoxy-N-[(1S,2R)-2-nitro-1-phenylbutyl]aniline Traditional Name: (4-methoxyphenyl)-[(1S,2R)-2-nitro-1-phenyl-butyl]amine Formula: C17H20N2O3 MolecularWeight: 300.3523

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(C1=CC=CC=C1)NC2=CC=C(C=C2)OC)[N+](=O)[O-]

Isomeric SMILES

CC[C@H]([C@H](C1=CC=CC=C1)NC2=CC=C(C=C2)OC)[N+](=O)[O-]

InChI

InChI=1S/C17H20N2O3/c1-3-16(19(20)21)17(13-7-5-4-6-8-13)18-14-9-11-15(22-2)12-10-14/h4-12,16-18H,3H2,1-2H3/t16-,17+/m1/s1