(1-oxidanylidene-1-propoxy-propan-2-yl) 6-[4-[5-(1-oxidanylidene-1-propoxy-propan-2-yl)oxycarbonylpyridin-2-yl]piperazin-1-yl]pyridine-3-carboxylate

Systemtic Name: (1-oxidanylidene-1-propoxy-propan-2-yl) 6-[4-[5-(1-oxidanylidene-1-propoxy-propan-2-yl)oxycarbonylpyridin-2-yl]piperazin-1-yl]pyridine-3-carboxylate Openeye Name: (1-methyl-2-oxo-2-propoxy-ethyl) 6-[4-[5-(1-methyl-2-oxo-2-propoxy-ethoxy)carbonyl-2-pyridyl]piperazin-1-yl]pyridine-3-carboxylate CAS Name: 6-[4-[5-[oxo-(1-oxo-1-propoxypropan-2-yl)oxymethyl]-2-pyridinyl]-1-piperazinyl]-3-pyridinecarboxylic acid (1-oxo-1-propoxypropan-2-yl) ester IUPAC Name: (1-oxo-1-propoxypropan-2-yl) 6-[4-[5-(1-oxo-1-propoxypropan-2-yl)oxycarbonylpyridin-2-yl]piperazin-1-yl]pyridine-3-carboxylate Traditional Name: 6-[4-[5-(2-keto-1-methyl-2-propoxy-ethoxy)carbonyl-2-pyridyl]piperazino]nicotinic acid (2-keto-1-methyl-2-propoxy-ethyl) ester Formula: C28H36N4O8 MolecularWeight: 556.60744

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C(C)OC(=O)C1=CN=C(C=C1)N2CCN(CC2)C3=NC=C(C=C3)C(=O)OC(C)C(=O)OCCC

Isomeric SMILES

CCCOC(=O)C(C)OC(=O)C1=CN=C(C=C1)N2CCN(CC2)C3=NC=C(C=C3)C(=O)OC(C)C(=O)OCCC

InChI

InChI=1S/C28H36N4O8/c1-5-15-37-25(33)19(3)39-27(35)21-7-9-23(29-17-21)31-11-13-32(14-12-31)24-10-8-22(18-30-24)28(36)40-20(4)26(34)38-16-6-2/h7-10,17-20H,5-6,11-16H2,1-4H3