ethyl 1-[3-[4-(2-hydroxyethyl)piperazin-1-yl]phenyl]benzimidazole-5-carboxylate

Systemtic Name: ethyl 1-[3-[4-(2-hydroxyethyl)piperazin-1-yl]phenyl]benzimidazole-5-carboxylate Openeye Name: ethyl 1-[3-[4-(2-hydroxyethyl)piperazin-1-yl]phenyl]benzimidazole-5-carboxylate CAS Name: 1-[3-[4-(2-hydroxyethyl)-1-piperazinyl]phenyl]-5-benzimidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-[4-(2-hydroxyethyl)piperazin-1-yl]phenyl]benzimidazole-5-carboxylate Traditional Name: 1-[3-[4-(2-hydroxyethyl)piperazino]phenyl]benzimidazole-5-carboxylic acid ethyl ester Formula: C22H26N4O3 MolecularWeight: 394.46684

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C=C1)N(C=N2)C3=CC(=CC=C3)N4CCN(CC4)CCO

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=C1)N(C=N2)C3=CC(=CC=C3)N4CCN(CC4)CCO

InChI

InChI=1S/C22H26N4O3/c1-2-29-22(28)17-6-7-21-20(14-17)23-16-26(21)19-5-3-4-18(15-19)25-10-8-24(9-11-25)12-13-27/h3-7,14-16,27H,2,8-13H2,1H3