1-cyclohexyl-2-[3-[2-[(5-nitropyridin-2-yl)amino]ethylcarbamoyl]phenyl]benzimidazole-5-carboxylic acid

Systemtic Name: 1-cyclohexyl-2-[3-[2-[(5-nitropyridin-2-yl)amino]ethylcarbamoyl]phenyl]benzimidazole-5-carboxylic acid Openeye Name: 1-cyclohexyl-2-[3-[2-[(5-nitro-2-pyridyl)amino]ethylcarbamoyl]phenyl]benzimidazole-5-carboxylic acid CAS Name: 1-cyclohexyl-2-[3-[[2-[(5-nitro-2-pyridinyl)amino]ethylamino]-oxomethyl]phenyl]-5-benzimidazolecarboxylic acid IUPAC Name: 1-cyclohexyl-2-[3-[2-[(5-nitropyridin-2-yl)amino]ethylcarbamoyl]phenyl]benzimidazole-5-carboxylic acid Traditional Name: 1-cyclohexyl-2-[3-[2-[(5-nitro-2-pyridyl)amino]ethylcarbamoyl]phenyl]benzimidazole-5-carboxylic acid Formula: C28H28N6O5 MolecularWeight: 528.55912

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C3=C(C=C(C=C3)C(=O)O)N=C2C4=CC(=CC=C4)C(=O)NCCNC5=NC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)N2C3=C(C=C(C=C3)C(=O)O)N=C2C4=CC(=CC=C4)C(=O)NCCNC5=NC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C28H28N6O5/c35-27(30-14-13-29-25-12-10-22(17-31-25)34(38)39)19-6-4-5-18(15-19)26-32-23-16-20(28(36)37)9-11-24(23)33(26)21-7-2-1-3-8-21/h4-6,9-12,15-17,21H,1-3,7-8,13-14H2,(H,29,31)(H,30,35)(H,36,37)