N-[4-[(2-butylbenzimidazol-1-yl)methyl]-2-nitro-phenyl]benzamide hydrochloride

Systemtic Name: N-[4-[(2-butylbenzimidazol-1-yl)methyl]-2-nitro-phenyl]benzamide hydrochloride Openeye Name: N-[4-[(2-butylbenzimidazol-1-yl)methyl]-2-nitro-phenyl]benzamide hydrochloride CAS Name: N-[4-[(2-butyl-1-benzimidazolyl)methyl]-2-nitrophenyl]benzamide hydrochloride IUPAC Name: N-[4-[(2-butylbenzimidazol-1-yl)methyl]-2-nitrophenyl]benzamide hydrochloride Traditional Name: N-[4-[(2-butylbenzimidazol-1-yl)methyl]-2-nitro-phenyl]benzamide hydrochloride Formula: C25H25ClN4O3 MolecularWeight: 464.944

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=CC=CC=C2N1CC3=CC(=C(C=C3)NC(=O)C4=CC=CC=C4)[N+](=O)[O-].Cl

Isomeric SMILES

CCCCC1=NC2=CC=CC=C2N1CC3=CC(=C(C=C3)NC(=O)C4=CC=CC=C4)[N+](=O)[O-].Cl

InChI

InChI=1S/C25H24N4O3.ClH/c1-2-3-13-24-26-20-11-7-8-12-22(20)28(24)17-18-14-15-21(23(16-18)29(31)32)27-25(30)19-9-5-4-6-10-19;/h4-12,14-16H,2-3,13,17H2,1H3,(H,27,30);1H