(1R,2R)-N-[(2-methoxyphenyl)methyl]-1-(1-methylpyrrol-2-yl)-2-nitro-butan-1-amine

Systemtic Name: (1R,2R)-N-[(2-methoxyphenyl)methyl]-1-(1-methylpyrrol-2-yl)-2-nitro-butan-1-amine Openeye Name: (1R,2R)-N-[(2-methoxyphenyl)methyl]-1-(1-methylpyrrol-2-yl)-2-nitro-butan-1-amine CAS Name: (1R,2R)-N-[(2-methoxyphenyl)methyl]-1-(1-methyl-2-pyrrolyl)-2-nitro-1-butanamine IUPAC Name: (1R,2R)-N-[(2-methoxyphenyl)methyl]-1-(1-methylpyrrol-2-yl)-2-nitrobutan-1-amine Traditional Name: [(1R,2R)-1-(1-methylpyrrol-2-yl)-2-nitro-butyl]-o-anisyl-amine Formula: C17H23N3O3 MolecularWeight: 317.38282

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(C1=CC=CN1C)NCC2=CC=CC=C2OC)[N+](=O)[O-]

Isomeric SMILES

CC[C@H]([C@H](C1=CC=CN1C)NCC2=CC=CC=C2OC)[N+](=O)[O-]

InChI

InChI=1S/C17H23N3O3/c1-4-14(20(21)22)17(15-9-7-11-19(15)2)18-12-13-8-5-6-10-16(13)23-3/h5-11,14,17-18H,4,12H2,1-3H3/t14-,17-/m1/s1