2-[4-[(4-chloranylnaphthalen-1-yl)carbamoyl]phenyl]-1-cyclohexyl-benzimidazole-5-carboxylic acid

Systemtic Name: 2-[4-[(4-chloranylnaphthalen-1-yl)carbamoyl]phenyl]-1-cyclohexyl-benzimidazole-5-carboxylic acid Openeye Name: 2-[4-[(4-chloro-1-naphthyl)carbamoyl]phenyl]-1-cyclohexyl-benzimidazole-5-carboxylic acid CAS Name: 2-[4-[[(4-chloro-1-naphthalenyl)amino]-oxomethyl]phenyl]-1-cyclohexyl-5-benzimidazolecarboxylic acid IUPAC Name: 2-[4-[(4-chloronaphthalen-1-yl)carbamoyl]phenyl]-1-cyclohexylbenzimidazole-5-carboxylic acid Traditional Name: 2-[4-[(4-chloro-1-naphthyl)carbamoyl]phenyl]-1-cyclohexyl-benzimidazole-5-carboxylic acid Formula: C31H26ClN3O3 MolecularWeight: 524.00944

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C3=C(C=C(C=C3)C(=O)O)N=C2C4=CC=C(C=C4)C(=O)NC5=CC=C(C6=CC=CC=C65)Cl

Isomeric SMILES

C1CCC(CC1)N2C3=C(C=C(C=C3)C(=O)O)N=C2C4=CC=C(C=C4)C(=O)NC5=CC=C(C6=CC=CC=C65)Cl

InChI

InChI=1S/C31H26ClN3O3/c32-25-15-16-26(24-9-5-4-8-23(24)25)34-30(36)20-12-10-19(11-13-20)29-33-27-18-21(31(37)38)14-17-28(27)35(29)22-6-2-1-3-7-22/h4-5,8-18,22H,1-3,6-7H2,(H,34,36)(H,37,38)