N-[(1S)-1-(4-chlorophenyl)-2-nitro-ethyl]-2,4-dimethoxy-aniline

Systemtic Name: N-[(1S)-1-(4-chlorophenyl)-2-nitro-ethyl]-2,4-dimethoxy-aniline Openeye Name: N-[(1S)-1-(4-chlorophenyl)-2-nitro-ethyl]-2,4-dimethoxy-aniline CAS Name: N-[(1S)-1-(4-chlorophenyl)-2-nitroethyl]-2,4-dimethoxyaniline IUPAC Name: N-[(1S)-1-(4-chlorophenyl)-2-nitroethyl]-2,4-dimethoxyaniline Traditional Name: [(1S)-1-(4-chlorophenyl)-2-nitro-ethyl]-(2,4-dimethoxyphenyl)amine Formula: C16H17ClN2O4 MolecularWeight: 336.77018

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC(C[N+](=O)[O-])C2=CC=C(C=C2)Cl)OC

Isomeric SMILES

COC1=CC(=C(C=C1)N[C@H](C[N+](=O)[O-])C2=CC=C(C=C2)Cl)OC

InChI

InChI=1S/C16H17ClN2O4/c1-22-13-7-8-14(16(9-13)23-2)18-15(10-19(20)21)11-3-5-12(17)6-4-11/h3-9,15,18H,10H2,1-2H3/t15-/m1/s1