N-[2-(3,4-dimethoxyphenyl)ethyl]-4-nitro-3-(trifluoromethyl)aniline

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-nitro-3-(trifluoromethyl)aniline Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-nitro-3-(trifluoromethyl)aniline CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-nitro-3-(trifluoromethyl)aniline IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-nitro-3-(trifluoromethyl)aniline Traditional Name: homoveratryl-[4-nitro-3-(trifluoromethyl)phenyl]amine Formula: C17H17F3N2O4 MolecularWeight: 370.32309

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC2=CC(=C(C=C2)[N+](=O)[O-])C(F)(F)F)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC2=CC(=C(C=C2)[N+](=O)[O-])C(F)(F)F)OC

InChI

InChI=1S/C17H17F3N2O4/c1-25-15-6-3-11(9-16(15)26-2)7-8-21-12-4-5-14(22(23)24)13(10-12)17(18,19)20/h3-6,9-10,21H,7-8H2,1-2H3