1-[3-[(4-nitrophenyl)methoxy]phenyl]-N-(pyridin-3-ylmethyl)benzimidazole-5-carboxamide

Systemtic Name: 1-[3-[(4-nitrophenyl)methoxy]phenyl]-N-(pyridin-3-ylmethyl)benzimidazole-5-carboxamide Openeye Name: 1-[3-[(4-nitrophenyl)methoxy]phenyl]-N-(3-pyridylmethyl)benzimidazole-5-carboxamide CAS Name: 1-[3-[(4-nitrophenyl)methoxy]phenyl]-N-(3-pyridinylmethyl)-5-benzimidazolecarboxamide IUPAC Name: 1-[3-[(4-nitrophenyl)methoxy]phenyl]-N-(pyridin-3-ylmethyl)benzimidazole-5-carboxamide Traditional Name: 1-[3-(4-nitrobenzyl)oxyphenyl]-N-(3-pyridylmethyl)benzimidazole-5-carboxamide Formula: C27H21N5O4 MolecularWeight: 479.48674

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OCC2=CC=C(C=C2)[N+](=O)[O-])N3C=NC4=C3C=CC(=C4)C(=O)NCC5=CN=CC=C5

Isomeric SMILES

C1=CC(=CC(=C1)OCC2=CC=C(C=C2)[N+](=O)[O-])N3C=NC4=C3C=CC(=C4)C(=O)NCC5=CN=CC=C5

InChI

InChI=1S/C27H21N5O4/c33-27(29-16-20-3-2-12-28-15-20)21-8-11-26-25(13-21)30-18-31(26)23-4-1-5-24(14-23)36-17-19-6-9-22(10-7-19)32(34)35/h1-15,18H,16-17H2,(H,29,33)