1-[4-(3a,4,5,6-tetrahydro-1H-perimidin-2-yl)piperazin-1-yl]-2-methyl-propan-1-one hydrochloride

Systemtic Name: 1-[4-(3a,4,5,6-tetrahydro-1H-perimidin-2-yl)piperazin-1-yl]-2-methyl-propan-1-one hydrochloride Openeye Name: 1-[4-(3a,4,5,6-tetrahydro-1H-perimidin-2-yl)piperazin-1-yl]-2-methyl-propan-1-one hydrochloride CAS Name: 1-[4-(3a,4,5,6-tetrahydro-1H-perimidin-2-yl)-1-piperazinyl]-2-methyl-1-propanone hydrochloride IUPAC Name: 1-[4-(3a,4,5,6-tetrahydro-1H-perimidin-2-yl)piperazin-1-yl]-2-methylpropan-1-one hydrochloride Traditional Name: 1-[4-(3a,4,5,6-tetrahydro-1H-perimidin-2-yl)piperazino]-2-methyl-propan-1-one hydrochloride Formula: C19H27ClN4O MolecularWeight: 362.89688

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CCN(CC1)C2=NC3CCCC4=C3C(=CC=C4)N2.Cl

Isomeric SMILES

CC(C)C(=O)N1CCN(CC1)C2=NC3CCCC4=C3C(=CC=C4)N2.Cl

InChI

InChI=1S/C19H26N4O.ClH/c1-13(2)18(24)22-9-11-23(12-10-22)19-20-15-7-3-5-14-6-4-8-16(21-19)17(14)15;/h3,5,7,13,16H,4,6,8-12H2,1-2H3,(H,20,21);1H