4-(4-chlorophenyl)-1-[4-(oxan-4-yl)piperazin-1-yl]butan-1-one hydrochloride

Systemtic Name: 4-(4-chlorophenyl)-1-[4-(oxan-4-yl)piperazin-1-yl]butan-1-one hydrochloride Openeye Name: 4-(4-chlorophenyl)-1-(4-tetrahydropyran-4-ylpiperazin-1-yl)butan-1-one hydrochloride CAS Name: 4-(4-chlorophenyl)-1-[4-(4-oxanyl)-1-piperazinyl]-1-butanone hydrochloride IUPAC Name: 4-(4-chlorophenyl)-1-[4-(oxan-4-yl)piperazin-1-yl]butan-1-one hydrochloride Traditional Name: 4-(4-chlorophenyl)-1-(4-tetrahydropyran-4-ylpiperazino)butan-1-one hydrochloride Formula: C19H28Cl2N2O2 MolecularWeight: 387.34382

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1N2CCN(CC2)C(=O)CCCC3=CC=C(C=C3)Cl.Cl

Isomeric SMILES

C1COCCC1N2CCN(CC2)C(=O)CCCC3=CC=C(C=C3)Cl.Cl

InChI

InChI=1S/C19H27ClN2O2.ClH/c20-17-6-4-16(5-7-17)2-1-3-19(23)22-12-10-21(11-13-22)18-8-14-24-15-9-18;/h4-7,18H,1-3,8-15H2;1H