methyl 3-[4-[6-(4-methylpiperazin-1-yl)-5-nitro-pyrimidin-4-yl]oxyphenyl]-3-oxidanylidene-propanoate

Systemtic Name: methyl 3-[4-[6-(4-methylpiperazin-1-yl)-5-nitro-pyrimidin-4-yl]oxyphenyl]-3-oxidanylidene-propanoate Openeye Name: methyl 3-[4-[6-(4-methylpiperazin-1-yl)-5-nitro-pyrimidin-4-yl]oxyphenyl]-3-oxo-propanoate CAS Name: 3-[4-[[6-(4-methyl-1-piperazinyl)-5-nitro-4-pyrimidinyl]oxy]phenyl]-3-oxopropanoic acid methyl ester IUPAC Name: methyl 3-[4-[6-(4-methylpiperazin-1-yl)-5-nitropyrimidin-4-yl]oxyphenyl]-3-oxopropanoate Traditional Name: 3-keto-3-[4-[6-(4-methylpiperazino)-5-nitro-pyrimidin-4-yl]oxyphenyl]propionic acid methyl ester Formula: C19H21N5O6 MolecularWeight: 415.39994

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21N5O6/c1-22-7-9-23(10-8-22)18-17(24(27)28)19(21-12-20-18)30-14-5-3-13(4-6-14)15(25)11-16(26)29-2/h3-6,12H,7-11H2,1-2H3