6-(3a,4,5,6,7,7a-hexahydro-1H-benzimidazol-2-yl)-2-(3-nitrophenyl)-1H-benzimidazole

Systemtic Name: 6-(3a,4,5,6,7,7a-hexahydro-1H-benzimidazol-2-yl)-2-(3-nitrophenyl)-1H-benzimidazole Openeye Name: 6-(3a,4,5,6,7,7a-hexahydro-1H-benzimidazol-2-yl)-2-(3-nitrophenyl)-1H-benzimidazole CAS Name: 6-(3a,4,5,6,7,7a-hexahydro-1H-benzimidazol-2-yl)-2-(3-nitrophenyl)-1H-benzimidazole IUPAC Name: 6-(3a,4,5,6,7,7a-hexahydro-1H-benzimidazol-2-yl)-2-(3-nitrophenyl)-1H-benzimidazole Traditional Name: 6-(3a,4,5,6,7,7a-hexahydro-1H-benzimidazol-2-yl)-2-(3-nitrophenyl)-1H-benzimidazole Formula: C20H19N5O2 MolecularWeight: 361.39716

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2C(C1)NC(=N2)C3=CC4=C(C=C3)N=C(N4)C5=CC(=CC=C5)[N+](=O)[O-]

Isomeric SMILES

C1CCC2C(C1)NC(=N2)C3=CC4=C(C=C3)N=C(N4)C5=CC(=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C20H19N5O2/c26-25(27)14-5-3-4-12(10-14)19-23-17-9-8-13(11-18(17)24-19)20-21-15-6-1-2-7-16(15)22-20/h3-5,8-11,15-16H,1-2,6-7H2,(H,21,22)(H,23,24)