N-(3-methanoyl-2,5-dimethyl-pyrrol-1-yl)-2-nitro-N-[(4-nitrophenyl)methyl]benzamide

Systemtic Name: N-(3-methanoyl-2,5-dimethyl-pyrrol-1-yl)-2-nitro-N-[(4-nitrophenyl)methyl]benzamide Openeye Name: N-(3-formyl-2,5-dimethyl-pyrrol-1-yl)-2-nitro-N-[(4-nitrophenyl)methyl]benzamide CAS Name: N-(3-formyl-2,5-dimethyl-1-pyrrolyl)-2-nitro-N-[(4-nitrophenyl)methyl]benzamide IUPAC Name: N-(3-formyl-2,5-dimethylpyrrol-1-yl)-2-nitro-N-[(4-nitrophenyl)methyl]benzamide Traditional Name: N-(3-formyl-2,5-dimethyl-pyrrol-1-yl)-2-nitro-N-(4-nitrobenzyl)benzamide Formula: C21H18N4O6 MolecularWeight: 422.39082

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1N(CC2=CC=C(C=C2)[N+](=O)[O-])C(=O)C3=CC=CC=C3[N+](=O)[O-])C)C=O

Isomeric SMILES

CC1=CC(=C(N1N(CC2=CC=C(C=C2)[N+](=O)[O-])C(=O)C3=CC=CC=C3[N+](=O)[O-])C)C=O

InChI

InChI=1S/C21H18N4O6/c1-14-11-17(13-26)15(2)23(14)22(12-16-7-9-18(10-8-16)24(28)29)21(27)19-5-3-4-6-20(19)25(30)31/h3-11,13H,12H2,1-2H3