1-[4-(2-oxidanyl-3-phenoxy-propyl)piperazin-1-yl]-2-phenoxy-ethanone hydrochloride

Systemtic Name: 1-[4-(2-oxidanyl-3-phenoxy-propyl)piperazin-1-yl]-2-phenoxy-ethanone hydrochloride Openeye Name: 1-[4-(2-hydroxy-3-phenoxy-propyl)piperazin-1-yl]-2-phenoxy-ethanone hydrochloride CAS Name: 1-[4-(2-hydroxy-3-phenoxypropyl)-1-piperazinyl]-2-phenoxyethanone hydrochloride IUPAC Name: 1-[4-(2-hydroxy-3-phenoxypropyl)piperazin-1-yl]-2-phenoxyethanone hydrochloride Traditional Name: 1-[4-(2-hydroxy-3-phenoxy-propyl)piperazino]-2-phenoxy-ethanone hydrochloride Formula: C21H27ClN2O4 MolecularWeight: 406.90308

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(COC2=CC=CC=C2)O)C(=O)COC3=CC=CC=C3.Cl

Isomeric SMILES

C1CN(CCN1CC(COC2=CC=CC=C2)O)C(=O)COC3=CC=CC=C3.Cl

InChI

InChI=1S/C21H26N2O4.ClH/c24-18(16-26-19-7-3-1-4-8-19)15-22-11-13-23(14-12-22)21(25)17-27-20-9-5-2-6-10-20;/h1-10,18,24H,11-17H2;1H