1,3-dimethyl-6-[4-[3-[2-(2-oxidanylidenepropoxy)phenoxy]propyl]piperazin-1-yl]pyrimidine-2,4-dione hydrochloride

Systemtic Name: 1,3-dimethyl-6-[4-[3-[2-(2-oxidanylidenepropoxy)phenoxy]propyl]piperazin-1-yl]pyrimidine-2,4-dione hydrochloride Openeye Name: 6-[4-[3-(2-acetonyloxyphenoxy)propyl]piperazin-1-yl]-1,3-dimethyl-pyrimidine-2,4-dione hydrochloride CAS Name: 1,3-dimethyl-6-[4-[3-[2-(2-oxopropoxy)phenoxy]propyl]-1-piperazinyl]pyrimidine-2,4-dione hydrochloride IUPAC Name: 1,3-dimethyl-6-[4-[3-[2-(2-oxopropoxy)phenoxy]propyl]piperazin-1-yl]pyrimidine-2,4-dione hydrochloride Traditional Name: 6-[4-[3-(2-acetonyloxyphenoxy)propyl]piperazino]-1,3-dimethyl-pyrimidine-2,4-quinone hydrochloride Formula: C22H31ClN4O5 MolecularWeight: 466.95834

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)COC1=CC=CC=C1OCCCN2CCN(CC2)C3=CC(=O)N(C(=O)N3C)C.Cl

Isomeric SMILES

CC(=O)COC1=CC=CC=C1OCCCN2CCN(CC2)C3=CC(=O)N(C(=O)N3C)C.Cl

InChI

InChI=1S/C22H30N4O5.ClH/c1-17(27)16-31-19-8-5-4-7-18(19)30-14-6-9-25-10-12-26(13-11-25)20-15-21(28)24(3)22(29)23(20)2;/h4-5,7-8,15H,6,9-14,16H2,1-3H3;1H