(phenylmethyl) 4-[1-(4-methoxycarbonylpiperidin-4-yl)-2-oxidanylidene-propyl]-3-oxidanylidene-2H-pyrazine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-[1-(4-methoxycarbonylpiperidin-4-yl)-2-oxidanylidene-propyl]-3-oxidanylidene-2H-pyrazine-1-carboxylate Openeye Name: benzyl 4-[1-(4-methoxycarbonyl-4-piperidyl)-2-oxo-propyl]-3-oxo-2H-pyrazine-1-carboxylate CAS Name: 4-[1-(4-methoxycarbonyl-4-piperidinyl)-2-oxopropyl]-3-oxo-2H-pyrazine-1-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[1-(4-methoxycarbonylpiperidin-4-yl)-2-oxopropyl]-3-oxo-2H-pyrazine-1-carboxylate Traditional Name: 4-[1-(4-carbomethoxy-4-piperidyl)-2-keto-propyl]-3-keto-2H-pyrazine-1-carboxylic acid benzyl ester Formula: C22H27N3O6 MolecularWeight: 429.46628

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C1(CCNCC1)C(=O)OC)N2C=CN(CC2=O)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC(=O)C(C1(CCNCC1)C(=O)OC)N2C=CN(CC2=O)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C22H27N3O6/c1-16(26)19(22(20(28)30-2)8-10-23-11-9-22)25-13-12-24(14-18(25)27)21(29)31-15-17-6-4-3-5-7-17/h3-7,12-13,19,23H,8-11,14-15H2,1-2H3