3-nitro-N-[(4-pyrrol-1-ylphenyl)methyl]benzamide

Systemtic Name: 3-nitro-N-[(4-pyrrol-1-ylphenyl)methyl]benzamide Openeye Name: 3-nitro-N-[(4-pyrrol-1-ylphenyl)methyl]benzamide CAS Name: 3-nitro-N-[[4-(1-pyrrolyl)phenyl]methyl]benzamide IUPAC Name: 3-nitro-N-[(4-pyrrol-1-ylphenyl)methyl]benzamide Traditional Name: 3-nitro-N-(4-pyrrol-1-ylbenzyl)benzamide Formula: C18H15N3O3 MolecularWeight: 321.33

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C=C1)C2=CC=C(C=C2)CNC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CN(C=C1)C2=CC=C(C=C2)CNC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H15N3O3/c22-18(15-4-3-5-17(12-15)21(23)24)19-13-14-6-8-16(9-7-14)20-10-1-2-11-20/h1-12H,13H2,(H,19,22)