4-(2,5-dimethylpyrrol-1-yl)-N-[(E)-(4-nitrophenyl)methylideneamino]benzamide

Systemtic Name: 4-(2,5-dimethylpyrrol-1-yl)-N-[(E)-(4-nitrophenyl)methylideneamino]benzamide Openeye Name: 4-(2,5-dimethylpyrrol-1-yl)-N-[(E)-(4-nitrophenyl)methyleneamino]benzamide CAS Name: 4-(2,5-dimethyl-1-pyrrolyl)-N-[(E)-(4-nitrophenyl)methylideneamino]benzamide IUPAC Name: 4-(2,5-dimethylpyrrol-1-yl)-N-[(E)-(4-nitrophenyl)methylideneamino]benzamide Traditional Name: 4-(2,5-dimethylpyrrol-1-yl)-N-[(E)-(4-nitrobenzylidene)amino]benzamide Formula: C20H18N4O3 MolecularWeight: 362.38192

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C2=CC=C(C=C2)C(=O)NN=CC3=CC=C(C=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC=C(N1C2=CC=C(C=C2)C(=O)N/N=C/C3=CC=C(C=C3)[N+](=O)[O-])C

InChI

InChI=1S/C20H18N4O3/c1-14-3-4-15(2)23(14)18-11-7-17(8-12-18)20(25)22-21-13-16-5-9-19(10-6-16)24(26)27/h3-13H,1-2H3,(H,22,25)/b21-13+