2-[4-[2-azanylethoxy-(4-chlorophenyl)methyl]phenyl]-3H-benzimidazole-5-carboxylic acid

Systemtic Name: 2-[4-[2-azanylethoxy-(4-chlorophenyl)methyl]phenyl]-3H-benzimidazole-5-carboxylic acid Openeye Name: 2-[4-[2-aminoethoxy-(4-chlorophenyl)methyl]phenyl]-3H-benzimidazole-5-carboxylic acid CAS Name: 2-[4-[2-aminoethoxy-(4-chlorophenyl)methyl]phenyl]-3H-benzimidazole-5-carboxylic acid IUPAC Name: 2-[4-[2-aminoethoxy-(4-chlorophenyl)methyl]phenyl]-3H-benzimidazole-5-carboxylic acid Traditional Name: 2-[4-[2-aminoethoxy-(4-chlorophenyl)methyl]phenyl]-3H-benzimidazole-5-carboxylic acid Formula: C23H20ClN3O3 MolecularWeight: 421.8762

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H20ClN3O3/c24-18-8-5-15(6-9-18)21(30-12-11-25)14-1-3-16(4-2-14)22-26-19-10-7-17(23(28)29)13-20(19)27-22/h1-10,13,21H,11-12,25H2,(H,26,27)(H,28,29)