1-(2-phenyl-3H-benzimidazol-5-yl)-3-[1-(phenylmethyl)piperidin-4-yl]propan-1-one hydrochloride

Systemtic Name: 1-(2-phenyl-3H-benzimidazol-5-yl)-3-[1-(phenylmethyl)piperidin-4-yl]propan-1-one hydrochloride Openeye Name: 3-(1-benzyl-4-piperidyl)-1-(2-phenyl-3H-benzimidazol-5-yl)propan-1-one hydrochloride CAS Name: 1-(2-phenyl-3H-benzimidazol-5-yl)-3-[1-(phenylmethyl)-4-piperidinyl]-1-propanone hydrochloride IUPAC Name: 3-(1-benzylpiperidin-4-yl)-1-(2-phenyl-3H-benzimidazol-5-yl)propan-1-one hydrochloride Traditional Name: 3-(1-benzyl-4-piperidyl)-1-(2-phenyl-3H-benzimidazol-5-yl)propan-1-one hydrochloride Formula: C28H30ClN3O MolecularWeight: 460.0103

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CCC(=O)C2=CC3=C(C=C2)N=C(N3)C4=CC=CC=C4)CC5=CC=CC=C5.Cl

Isomeric SMILES

C1CN(CCC1CCC(=O)C2=CC3=C(C=C2)N=C(N3)C4=CC=CC=C4)CC5=CC=CC=C5.Cl

InChI

InChI=1S/C28H29N3O.ClH/c32-27(14-11-21-15-17-31(18-16-21)20-22-7-3-1-4-8-22)24-12-13-25-26(19-24)30-28(29-25)23-9-5-2-6-10-23;/h1-10,12-13,19,21H,11,14-18,20H2,(H,29,30);1H