N-(1H-imidazol-2-yl)-2-[(4-nitrophenyl)carbonylamino]-1H-benzimidazole-4-carboxamide

Systemtic Name: N-(1H-imidazol-2-yl)-2-[(4-nitrophenyl)carbonylamino]-1H-benzimidazole-4-carboxamide Openeye Name: N-(1H-imidazol-2-yl)-2-[(4-nitrobenzoyl)amino]-1H-benzimidazole-4-carboxamide CAS Name: N-(1H-imidazol-2-yl)-2-[[(4-nitrophenyl)-oxomethyl]amino]-1H-benzimidazole-4-carboxamide IUPAC Name: N-(1H-imidazol-2-yl)-2-[(4-nitrobenzoyl)amino]-1H-benzimidazole-4-carboxamide Traditional Name: N-(1H-imidazol-2-yl)-2-[(4-nitrobenzoyl)amino]-1H-benzimidazole-4-carboxamide Formula: C18H13N7O4 MolecularWeight: 391.34032

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C(=C1)NC(=N2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)NC4=NC=CN4

Isomeric SMILES

C1=CC(=C2C(=C1)NC(=N2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)NC4=NC=CN4

InChI

InChI=1S/C18H13N7O4/c26-15(10-4-6-11(7-5-10)25(28)29)23-18-21-13-3-1-2-12(14(13)22-18)16(27)24-17-19-8-9-20-17/h1-9H,(H2,19,20,24,27)(H2,21,22,23,26)