(phenylmethyl) 4-[3-[2-(methylamino)-2-oxidanylidene-ethyl]-2-oxidanylidene-1,3-diazinan-1-yl]piperidine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-[3-[2-(methylamino)-2-oxidanylidene-ethyl]-2-oxidanylidene-1,3-diazinan-1-yl]piperidine-1-carboxylate Openeye Name: benzyl 4-[3-[2-(methylamino)-2-oxo-ethyl]-2-oxo-hexahydropyrimidin-1-yl]piperidine-1-carboxylate CAS Name: 4-[3-[2-(methylamino)-2-oxoethyl]-2-oxo-1,3-diazinan-1-yl]-1-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[3-[2-(methylamino)-2-oxoethyl]-2-oxo-1,3-diazinan-1-yl]piperidine-1-carboxylate Traditional Name: 4-[2-keto-3-[2-keto-2-(methylamino)ethyl]hexahydropyrimidin-1-yl]piperidine-1-carboxylic acid benzyl ester Formula: C20H28N4O4 MolecularWeight: 388.46072

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)CN1CCCN(C1=O)C2CCN(CC2)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CNC(=O)CN1CCCN(C1=O)C2CCN(CC2)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C20H28N4O4/c1-21-18(25)14-23-10-5-11-24(19(23)26)17-8-12-22(13-9-17)20(27)28-15-16-6-3-2-4-7-16/h2-4,6-7,17H,5,8-15H2,1H3,(H,21,25)