6,7-dimethoxy-2-[6-(4-methylpiperazin-1-yl)-5-nitro-pyrimidin-4-yl]-3,4-dihydro-1H-isoquinoline

Systemtic Name: 6,7-dimethoxy-2-[6-(4-methylpiperazin-1-yl)-5-nitro-pyrimidin-4-yl]-3,4-dihydro-1H-isoquinoline Openeye Name: 6,7-dimethoxy-2-[6-(4-methylpiperazin-1-yl)-5-nitro-pyrimidin-4-yl]-3,4-dihydro-1H-isoquinoline CAS Name: 6,7-dimethoxy-2-[6-(4-methyl-1-piperazinyl)-5-nitro-4-pyrimidinyl]-3,4-dihydro-1H-isoquinoline IUPAC Name: 6,7-dimethoxy-2-[6-(4-methylpiperazin-1-yl)-5-nitropyrimidin-4-yl]-3,4-dihydro-1H-isoquinoline Traditional Name: 6,7-dimethoxy-2-[6-(4-methylpiperazino)-5-nitro-pyrimidin-4-yl]-3,4-dihydro-1H-isoquinoline Formula: C20H26N6O4 MolecularWeight: 414.45824

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NC=NC(=C2[N+](=O)[O-])N3CCC4=CC(=C(C=C4C3)OC)OC

Isomeric SMILES

CN1CCN(CC1)C2=NC=NC(=C2[N+](=O)[O-])N3CCC4=CC(=C(C=C4C3)OC)OC

InChI

InChI=1S/C20H26N6O4/c1-23-6-8-24(9-7-23)19-18(26(27)28)20(22-13-21-19)25-5-4-14-10-16(29-2)17(30-3)11-15(14)12-25/h10-11,13H,4-9,12H2,1-3H3