4-(methoxymethyl)-7-[6-(4-methylpiperazin-1-yl)-5-nitro-pyrimidin-4-yl]oxy-chromen-2-one

Systemtic Name: 4-(methoxymethyl)-7-[6-(4-methylpiperazin-1-yl)-5-nitro-pyrimidin-4-yl]oxy-chromen-2-one Openeye Name: 4-(methoxymethyl)-7-[6-(4-methylpiperazin-1-yl)-5-nitro-pyrimidin-4-yl]oxy-chromen-2-one CAS Name: 4-(methoxymethyl)-7-[[6-(4-methyl-1-piperazinyl)-5-nitro-4-pyrimidinyl]oxy]-1-benzopyran-2-one IUPAC Name: 4-(methoxymethyl)-7-[6-(4-methylpiperazin-1-yl)-5-nitropyrimidin-4-yl]oxychromen-2-one Traditional Name: 4-(methoxymethyl)-7-[6-(4-methylpiperazino)-5-nitro-pyrimidin-4-yl]oxy-coumarin Formula: C20H21N5O6 MolecularWeight: 427.41064

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C(=NC=N2)OC3=CC4=C(C=C3)C(=CC(=O)O4)COC)[N+](=O)[O-]

Isomeric SMILES

CN1CCN(CC1)C2=C(C(=NC=N2)OC3=CC4=C(C=C3)C(=CC(=O)O4)COC)[N+](=O)[O-]

InChI

InChI=1S/C20H21N5O6/c1-23-5-7-24(8-6-23)19-18(25(27)28)20(22-12-21-19)30-14-3-4-15-13(11-29-2)9-17(26)31-16(15)10-14/h3-4,9-10,12H,5-8,11H2,1-2H3