1-[4-[4-[1-(2-ethoxyethyl)benzimidazol-2-yl]piperazin-1-yl]butyl]pyrazole-4-carboxylic acid

Systemtic Name: 1-[4-[4-[1-(2-ethoxyethyl)benzimidazol-2-yl]piperazin-1-yl]butyl]pyrazole-4-carboxylic acid Openeye Name: 1-[4-[4-[1-(2-ethoxyethyl)benzimidazol-2-yl]piperazin-1-yl]butyl]pyrazole-4-carboxylic acid CAS Name: 1-[4-[4-[1-(2-ethoxyethyl)-2-benzimidazolyl]-1-piperazinyl]butyl]-4-pyrazolecarboxylic acid IUPAC Name: 1-[4-[4-[1-(2-ethoxyethyl)benzimidazol-2-yl]piperazin-1-yl]butyl]pyrazole-4-carboxylic acid Traditional Name: 1-[4-[4-[1-(2-ethoxyethyl)benzimidazol-2-yl]piperazino]butyl]pyrazole-4-carboxylic acid Formula: C23H32N6O3 MolecularWeight: 440.53858

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCN1C2=CC=CC=C2N=C1N3CCN(CC3)CCCCN4C=C(C=N4)C(=O)O

Isomeric SMILES

CCOCCN1C2=CC=CC=C2N=C1N3CCN(CC3)CCCCN4C=C(C=N4)C(=O)O

InChI

InChI=1S/C23H32N6O3/c1-2-32-16-15-29-21-8-4-3-7-20(21)25-23(29)27-13-11-26(12-14-27)9-5-6-10-28-18-19(17-24-28)22(30)31/h3-4,7-8,17-18H,2,5-6,9-16H2,1H3,(H,30,31)