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

Systemtic Name: N-methyl-2-(4-nitrophenyl)-N-[2-(4-nitro-2-pyrrol-1-yl-phenoxy)ethyl]ethanamine Openeye Name: N-methyl-2-(4-nitrophenyl)-N-[2-(4-nitro-2-pyrrol-1-yl-phenoxy)ethyl]ethanamine CAS Name: N-methyl-2-(4-nitrophenyl)-N-[2-[4-nitro-2-(1-pyrrolyl)phenoxy]ethyl]ethanamine IUPAC Name: N-methyl-2-(4-nitrophenyl)-N-[2-(4-nitro-2-pyrrol-1-ylphenoxy)ethyl]ethanamine Traditional Name: methyl-[2-(4-nitrophenyl)ethyl]-[2-(4-nitro-2-pyrrol-1-yl-phenoxy)ethyl]amine Formula: C21H22N4O5 MolecularWeight: 410.42318

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22N4O5/c1-22(13-10-17-4-6-18(7-5-17)24(26)27)14-15-30-21-9-8-19(25(28)29)16-20(21)23-11-2-3-12-23/h2-9,11-12,16H,10,13-15H2,1H3