4-(4-methylphenyl)-5-[2-(4-phenylpiperazin-1-yl)ethyl]-1,3-dioxol-2-one hydrochloride

Systemtic Name: 4-(4-methylphenyl)-5-[2-(4-phenylpiperazin-1-yl)ethyl]-1,3-dioxol-2-one hydrochloride Openeye Name: 4-[2-(4-phenylpiperazin-1-yl)ethyl]-5-(p-tolyl)-1,3-dioxol-2-one hydrochloride CAS Name: 4-(4-methylphenyl)-5-[2-(4-phenyl-1-piperazinyl)ethyl]-1,3-dioxol-2-one hydrochloride IUPAC Name: 4-(4-methylphenyl)-5-[2-(4-phenylpiperazin-1-yl)ethyl]-1,3-dioxol-2-one hydrochloride Traditional Name: 4-[2-(4-phenylpiperazino)ethyl]-5-(p-tolyl)-1,3-dioxol-2-one hydrochloride Formula: C22H25ClN2O3 MolecularWeight: 400.8985

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(OC(=O)O2)CCN3CCN(CC3)C4=CC=CC=C4.Cl

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(OC(=O)O2)CCN3CCN(CC3)C4=CC=CC=C4.Cl

InChI

InChI=1S/C22H24N2O3.ClH/c1-17-7-9-18(10-8-17)21-20(26-22(25)27-21)11-12-23-13-15-24(16-14-23)19-5-3-2-4-6-19;/h2-10H,11-16H2,1H3;1H