5,6-dimethoxy-2-[4-(2-phenoxyethyl)piperazin-1-yl]-2,3-dihydroinden-1-one hydrochloride

Systemtic Name: 5,6-dimethoxy-2-[4-(2-phenoxyethyl)piperazin-1-yl]-2,3-dihydroinden-1-one hydrochloride Openeye Name: 5,6-dimethoxy-2-[4-(2-phenoxyethyl)piperazin-1-yl]indan-1-one hydrochloride CAS Name: 5,6-dimethoxy-2-[4-(2-phenoxyethyl)-1-piperazinyl]-2,3-dihydroinden-1-one hydrochloride IUPAC Name: 5,6-dimethoxy-2-[4-(2-phenoxyethyl)piperazin-1-yl]-2,3-dihydroinden-1-one hydrochloride Traditional Name: 5,6-dimethoxy-2-[4-(2-phenoxyethyl)piperazino]indan-1-one hydrochloride Formula: C23H29ClN2O4 MolecularWeight: 432.94036

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)CC(C2=O)N3CCN(CC3)CCOC4=CC=CC=C4)OC.Cl

Isomeric SMILES

COC1=C(C=C2C(=C1)CC(C2=O)N3CCN(CC3)CCOC4=CC=CC=C4)OC.Cl

InChI

InChI=1S/C23H28N2O4.ClH/c1-27-21-15-17-14-20(23(26)19(17)16-22(21)28-2)25-10-8-24(9-11-25)12-13-29-18-6-4-3-5-7-18;/h3-7,15-16,20H,8-14H2,1-2H3;1H