methyl [2-(oxidanylidenemethylidene)-1-(4-pyridin-4-ylpiperazin-1-yl)piperidin-4-yl] carbonate

Systemtic Name: methyl [2-(oxidanylidenemethylidene)-1-(4-pyridin-4-ylpiperazin-1-yl)piperidin-4-yl] carbonate Openeye Name: methyl [2-(oxomethylene)-1-[4-(4-pyridyl)piperazin-1-yl]-4-piperidyl] carbonate CAS Name: carbonic acid methyl [2-(oxomethylidene)-1-(4-pyridin-4-yl-1-piperazinyl)-4-piperidinyl] ester IUPAC Name: methyl [2-(oxomethylidene)-1-(4-pyridin-4-ylpiperazin-1-yl)piperidin-4-yl] carbonate Traditional Name: carbonic acid [2-(ketomethylene)-1-[4-(4-pyridyl)piperazino]-4-piperidyl] methyl ester Formula: C17H22N4O4 MolecularWeight: 346.38098

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)OC1CCN(C(=C=O)C1)N2CCN(CC2)C3=CC=NC=C3

Isomeric SMILES

COC(=O)OC1CCN(C(=C=O)C1)N2CCN(CC2)C3=CC=NC=C3

InChI

InChI=1S/C17H22N4O4/c1-24-17(23)25-16-4-7-21(15(12-16)13-22)20-10-8-19(9-11-20)14-2-5-18-6-3-14/h2-3,5-6,16H,4,7-12H2,1H3