ethanedioic acid; 1-[4-[[4-(2-pyrrolidin-1-ylethyl)piperazin-1-yl]methyl]phenyl]benzimidazole

Systemtic Name: ethanedioic acid; 1-[4-[[4-(2-pyrrolidin-1-ylethyl)piperazin-1-yl]methyl]phenyl]benzimidazole Openeye Name: oxalic acid; 1-[4-[[4-(2-pyrrolidin-1-ylethyl)piperazin-1-yl]methyl]phenyl]benzimidazole CAS Name: oxalic acid; 1-[4-[[4-[2-(1-pyrrolidinyl)ethyl]-1-piperazinyl]methyl]phenyl]benzimidazole IUPAC Name: oxalic acid; 1-[4-[[4-(2-pyrrolidin-1-ylethyl)piperazin-1-yl]methyl]phenyl]benzimidazole Traditional Name: oxalic acid; 1-[4-[[4-(2-pyrrolidinoethyl)piperazino]methyl]phenyl]benzimidazole Formula: C26H33N5O4 MolecularWeight: 479.57132

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCN2CCN(CC2)CC3=CC=C(C=C3)N4C=NC5=CC=CC=C54.C(=O)(C(=O)O)O

Isomeric SMILES

C1CCN(C1)CCN2CCN(CC2)CC3=CC=C(C=C3)N4C=NC5=CC=CC=C54.C(=O)(C(=O)O)O

InChI

InChI=1S/C24H31N5.C2H2O4/c1-2-6-24-23(5-1)25-20-29(24)22-9-7-21(8-10-22)19-28-17-15-27(16-18-28)14-13-26-11-3-4-12-26;3-1(4)2(5)6/h1-2,5-10,20H,3-4,11-19H2;(H,3,4)(H,5,6)