2-(4-pyrimidin-2-ylpiperazin-1-yl)-1-(3,4,5-trimethoxyphenyl)propan-1-one dihydrochloride

Systemtic Name: 2-(4-pyrimidin-2-ylpiperazin-1-yl)-1-(3,4,5-trimethoxyphenyl)propan-1-one dihydrochloride Openeye Name: 2-(4-pyrimidin-2-ylpiperazin-1-yl)-1-(3,4,5-trimethoxyphenyl)propan-1-one dihydrochloride CAS Name: 2-[4-(2-pyrimidinyl)-1-piperazinyl]-1-(3,4,5-trimethoxyphenyl)-1-propanone dihydrochloride IUPAC Name: 2-(4-pyrimidin-2-ylpiperazin-1-yl)-1-(3,4,5-trimethoxyphenyl)propan-1-one dihydrochloride Traditional Name: 2-[4-(2-pyrimidyl)piperazino]-1-(3,4,5-trimethoxyphenyl)propan-1-one dihydrochloride Formula: C20H28Cl2N4O4 MolecularWeight: 459.36672

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC(=C(C(=C1)OC)OC)OC)N2CCN(CC2)C3=NC=CC=N3.Cl.Cl

Isomeric SMILES

CC(C(=O)C1=CC(=C(C(=C1)OC)OC)OC)N2CCN(CC2)C3=NC=CC=N3.Cl.Cl

InChI

InChI=1S/C20H26N4O4.2ClH/c1-14(23-8-10-24(11-9-23)20-21-6-5-7-22-20)18(25)15-12-16(26-2)19(28-4)17(13-15)27-3;;/h5-7,12-14H,8-11H2,1-4H3;2*1H