1-[3-[4-(diphenylmethyl)piperazin-1-yl]propyl]-3-methyl-benzimidazol-2-one hydrate dihydrochloride

Systemtic Name: 1-[3-[4-(diphenylmethyl)piperazin-1-yl]propyl]-3-methyl-benzimidazol-2-one hydrate dihydrochloride Openeye Name: 1-[3-(4-benzhydrylpiperazin-1-yl)propyl]-3-methyl-benzimidazol-2-one hydrate dihydrochloride CAS Name: 1-[3-[4-(diphenylmethyl)-1-piperazinyl]propyl]-3-methyl-2-benzimidazolone hydrate dihydrochloride IUPAC Name: 1-[3-(4-benzhydrylpiperazin-1-yl)propyl]-3-methylbenzimidazol-2-one hydrate dihydrochloride Traditional Name: 1-[3-(4-benzhydrylpiperazino)propyl]-3-methyl-benzimidazol-2-one hydrate dihydrochloride Formula: C28H36Cl2N4O2 MolecularWeight: 531.51704

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N(C1=O)CCCN3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5.O.Cl.Cl

Isomeric SMILES

CN1C2=CC=CC=C2N(C1=O)CCCN3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5.O.Cl.Cl

InChI

InChI=1S/C28H32N4O.2ClH.H2O/c1-29-25-15-8-9-16-26(25)32(28(29)33)18-10-17-30-19-21-31(22-20-30)27(23-11-4-2-5-12-23)24-13-6-3-7-14-24;;;/h2-9,11-16,27H,10,17-22H2,1H3;2*1H;1H2