4-chloranyl-N-[(1R,2R)-1-(4-methoxyphenyl)-2-nitro-butyl]aniline

Systemtic Name: 4-chloranyl-N-[(1R,2R)-1-(4-methoxyphenyl)-2-nitro-butyl]aniline Openeye Name: 4-chloro-N-[(1R,2R)-1-(4-methoxyphenyl)-2-nitro-butyl]aniline CAS Name: 4-chloro-N-[(1R,2R)-1-(4-methoxyphenyl)-2-nitrobutyl]aniline IUPAC Name: 4-chloro-N-[(1R,2R)-1-(4-methoxyphenyl)-2-nitrobutyl]aniline Traditional Name: (4-chlorophenyl)-[(1R,2R)-1-(4-methoxyphenyl)-2-nitro-butyl]amine Formula: C17H19ClN2O3 MolecularWeight: 334.79736

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19ClN2O3/c1-3-16(20(21)22)17(12-4-10-15(23-2)11-5-12)19-14-8-6-13(18)7-9-14/h4-11,16-17,19H,3H2,1-2H3/t16-,17-/m1/s1