2-(3,4-dimethoxyphenyl)-N-methyl-N-[2-(4-nitro-2-pyrrol-1-yl-phenoxy)ethyl]ethanamine

Systemtic Name: 2-(3,4-dimethoxyphenyl)-N-methyl-N-[2-(4-nitro-2-pyrrol-1-yl-phenoxy)ethyl]ethanamine Openeye Name: 2-(3,4-dimethoxyphenyl)-N-methyl-N-[2-(4-nitro-2-pyrrol-1-yl-phenoxy)ethyl]ethanamine CAS Name: 2-(3,4-dimethoxyphenyl)-N-methyl-N-[2-[4-nitro-2-(1-pyrrolyl)phenoxy]ethyl]ethanamine IUPAC Name: 2-(3,4-dimethoxyphenyl)-N-methyl-N-[2-(4-nitro-2-pyrrol-1-ylphenoxy)ethyl]ethanamine Traditional Name: homoveratryl-methyl-[2-(4-nitro-2-pyrrol-1-yl-phenoxy)ethyl]amine Formula: C23H27N3O5 MolecularWeight: 425.47758

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC(=C(C=C1)OC)OC)CCOC2=C(C=C(C=C2)[N+](=O)[O-])N3C=CC=C3

Isomeric SMILES

CN(CCC1=CC(=C(C=C1)OC)OC)CCOC2=C(C=C(C=C2)[N+](=O)[O-])N3C=CC=C3

InChI

InChI=1S/C23H27N3O5/c1-24(13-10-18-6-8-22(29-2)23(16-18)30-3)14-15-31-21-9-7-19(26(27)28)17-20(21)25-11-4-5-12-25/h4-9,11-12,16-17H,10,13-15H2,1-3H3