1,3-dimethyl-6-[4-[2-(4-nitrophenyl)ethyl]piperazin-1-yl]pyrimidine-2,4-dione hydrochloride

Systemtic Name: 1,3-dimethyl-6-[4-[2-(4-nitrophenyl)ethyl]piperazin-1-yl]pyrimidine-2,4-dione hydrochloride Openeye Name: 1,3-dimethyl-6-[4-[2-(4-nitrophenyl)ethyl]piperazin-1-yl]pyrimidine-2,4-dione hydrochloride CAS Name: 1,3-dimethyl-6-[4-[2-(4-nitrophenyl)ethyl]-1-piperazinyl]pyrimidine-2,4-dione hydrochloride IUPAC Name: 1,3-dimethyl-6-[4-[2-(4-nitrophenyl)ethyl]piperazin-1-yl]pyrimidine-2,4-dione hydrochloride Traditional Name: 1,3-dimethyl-6-[4-[2-(4-nitrophenyl)ethyl]piperazino]pyrimidine-2,4-quinone hydrochloride Formula: C18H24ClN5O4 MolecularWeight: 409.86726

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC(=O)N(C1=O)C)N2CCN(CC2)CCC3=CC=C(C=C3)[N+](=O)[O-].Cl

Isomeric SMILES

CN1C(=CC(=O)N(C1=O)C)N2CCN(CC2)CCC3=CC=C(C=C3)[N+](=O)[O-].Cl

InChI

InChI=1S/C18H23N5O4.ClH/c1-19-16(13-17(24)20(2)18(19)25)22-11-9-21(10-12-22)8-7-14-3-5-15(6-4-14)23(26)27;/h3-6,13H,7-12H2,1-2H3;1H