butyl 1-[3-[4-(2-ethoxyethyl)piperazin-1-yl]phenyl]benzimidazole-5-carboxylate

Systemtic Name: butyl 1-[3-[4-(2-ethoxyethyl)piperazin-1-yl]phenyl]benzimidazole-5-carboxylate Openeye Name: butyl 1-[3-[4-(2-ethoxyethyl)piperazin-1-yl]phenyl]benzimidazole-5-carboxylate CAS Name: 1-[3-[4-(2-ethoxyethyl)-1-piperazinyl]phenyl]-5-benzimidazolecarboxylic acid butyl ester IUPAC Name: butyl 1-[3-[4-(2-ethoxyethyl)piperazin-1-yl]phenyl]benzimidazole-5-carboxylate Traditional Name: 1-[3-[4-(2-ethoxyethyl)piperazino]phenyl]benzimidazole-5-carboxylic acid butyl ester Formula: C26H34N4O3 MolecularWeight: 450.57316

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC2=C(C=C1)N(C=N2)C3=CC(=CC=C3)N4CCN(CC4)CCOCC

Isomeric SMILES

CCCCOC(=O)C1=CC2=C(C=C1)N(C=N2)C3=CC(=CC=C3)N4CCN(CC4)CCOCC

InChI

InChI=1S/C26H34N4O3/c1-3-5-16-33-26(31)21-9-10-25-24(18-21)27-20-30(25)23-8-6-7-22(19-23)29-13-11-28(12-14-29)15-17-32-4-2/h6-10,18-20H,3-5,11-17H2,1-2H3