1-[8-(4-azanylpiperidin-1-yl)quinolin-2-yl]-2-ethyl-benzimidazole-5-carboxylic acid

Systemtic Name: 1-[8-(4-azanylpiperidin-1-yl)quinolin-2-yl]-2-ethyl-benzimidazole-5-carboxylic acid Openeye Name: 1-[8-(4-amino-1-piperidyl)-2-quinolyl]-2-ethyl-benzimidazole-5-carboxylic acid CAS Name: 1-[8-(4-amino-1-piperidinyl)-2-quinolinyl]-2-ethyl-5-benzimidazolecarboxylic acid IUPAC Name: 1-[8-(4-aminopiperidin-1-yl)quinolin-2-yl]-2-ethylbenzimidazole-5-carboxylic acid Traditional Name: 1-[8-(4-aminopiperidino)-2-quinolyl]-2-ethyl-benzimidazole-5-carboxylic acid Formula: C24H25N5O2 MolecularWeight: 415.4876

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(N1C3=NC4=C(C=CC=C4N5CCC(CC5)N)C=C3)C=CC(=C2)C(=O)O

Isomeric SMILES

CCC1=NC2=C(N1C3=NC4=C(C=CC=C4N5CCC(CC5)N)C=C3)C=CC(=C2)C(=O)O

InChI

InChI=1S/C24H25N5O2/c1-2-21-26-18-14-16(24(30)31)6-8-19(18)29(21)22-9-7-15-4-3-5-20(23(15)27-22)28-12-10-17(25)11-13-28/h3-9,14,17H,2,10-13,25H2,1H3,(H,30,31)