methyl 1-[3-[4-(phenylmethyl)piperazin-1-yl]phenyl]benzimidazole-5-carboxylate

Systemtic Name: methyl 1-[3-[4-(phenylmethyl)piperazin-1-yl]phenyl]benzimidazole-5-carboxylate Openeye Name: methyl 1-[3-(4-benzylpiperazin-1-yl)phenyl]benzimidazole-5-carboxylate CAS Name: 1-[3-[4-(phenylmethyl)-1-piperazinyl]phenyl]-5-benzimidazolecarboxylic acid methyl ester IUPAC Name: methyl 1-[3-(4-benzylpiperazin-1-yl)phenyl]benzimidazole-5-carboxylate Traditional Name: 1-[3-(4-benzylpiperazino)phenyl]benzimidazole-5-carboxylic acid methyl ester Formula: C26H26N4O2 MolecularWeight: 426.51024

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)N(C=N2)C3=CC(=CC=C3)N4CCN(CC4)CC5=CC=CC=C5

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)N(C=N2)C3=CC(=CC=C3)N4CCN(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C26H26N4O2/c1-32-26(31)21-10-11-25-24(16-21)27-19-30(25)23-9-5-8-22(17-23)29-14-12-28(13-15-29)18-20-6-3-2-4-7-20/h2-11,16-17,19H,12-15,18H2,1H3