2-[4-(4-chlorophenyl)carbonylphenyl]-3H-benzimidazole-5-sulfonic acid

Systemtic Name: 2-[4-(4-chlorophenyl)carbonylphenyl]-3H-benzimidazole-5-sulfonic acid Openeye Name: 2-[4-(4-chlorobenzoyl)phenyl]-3H-benzimidazole-5-sulfonic acid CAS Name: 2-[4-[(4-chlorophenyl)-oxomethyl]phenyl]-3H-benzimidazole-5-sulfonic acid IUPAC Name: 2-[4-(4-chlorobenzoyl)phenyl]-3H-benzimidazole-5-sulfonic acid Traditional Name: 2-[4-(4-chlorobenzoyl)phenyl]-3H-benzimidazole-5-sulfonic acid Formula: C20H13ClN2O4S MolecularWeight: 412.84622

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NC3=C(N2)C=C(C=C3)S(=O)(=O)O)C(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC(=CC=C1C2=NC3=C(N2)C=C(C=C3)S(=O)(=O)O)C(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C20H13ClN2O4S/c21-15-7-5-13(6-8-15)19(24)12-1-3-14(4-2-12)20-22-17-10-9-16(28(25,26)27)11-18(17)23-20/h1-11H,(H,22,23)(H,25,26,27)