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

Systemtic Name: N-[(4-imidazol-1-ylphenyl)methyl]-3-nitro-benzamide Openeye Name: N-[(4-imidazol-1-ylphenyl)methyl]-3-nitro-benzamide CAS Name: N-[[4-(1-imidazolyl)phenyl]methyl]-3-nitrobenzamide IUPAC Name: N-[(4-imidazol-1-ylphenyl)methyl]-3-nitrobenzamide Traditional Name: N-(4-imidazol-1-ylbenzyl)-3-nitro-benzamide Formula: C17H14N4O3 MolecularWeight: 322.31806

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)NCC2=CC=C(C=C2)N3C=CN=C3

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)NCC2=CC=C(C=C2)N3C=CN=C3

InChI

InChI=1S/C17H14N4O3/c22-17(14-2-1-3-16(10-14)21(23)24)19-11-13-4-6-15(7-5-13)20-9-8-18-12-20/h1-10,12H,11H2,(H,19,22)