N-[(1S,2R)-1-[2,6-bis(chloranyl)phenyl]-2-nitro-butyl]-4-methoxy-aniline

Systemtic Name: N-[(1S,2R)-1-[2,6-bis(chloranyl)phenyl]-2-nitro-butyl]-4-methoxy-aniline Openeye Name: N-[(1S,2R)-1-(2,6-dichlorophenyl)-2-nitro-butyl]-4-methoxy-aniline CAS Name: N-[(1S,2R)-1-(2,6-dichlorophenyl)-2-nitrobutyl]-4-methoxyaniline IUPAC Name: N-[(1S,2R)-1-(2,6-dichlorophenyl)-2-nitrobutyl]-4-methoxyaniline Traditional Name: [(1S,2R)-1-(2,6-dichlorophenyl)-2-nitro-butyl]-(4-methoxyphenyl)amine Formula: C17H18Cl2N2O3 MolecularWeight: 369.24242

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(C1=C(C=CC=C1Cl)Cl)NC2=CC=C(C=C2)OC)[N+](=O)[O-]

Isomeric SMILES

CC[C@H]([C@H](C1=C(C=CC=C1Cl)Cl)NC2=CC=C(C=C2)OC)[N+](=O)[O-]

InChI

InChI=1S/C17H18Cl2N2O3/c1-3-15(21(22)23)17(16-13(18)5-4-6-14(16)19)20-11-7-9-12(24-2)10-8-11/h4-10,15,17,20H,3H2,1-2H3/t15-,17-/m1/s1