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

Systemtic Name: (phenylmethyl) 4-[3-(2-ethoxy-2-oxidanylidene-ethyl)-2-oxidanylidene-1,3-diazinan-1-yl]piperidine-1-carboxylate Openeye Name: benzyl 4-[3-(2-ethoxy-2-oxo-ethyl)-2-oxo-hexahydropyrimidin-1-yl]piperidine-1-carboxylate CAS Name: 4-[3-(2-ethoxy-2-oxoethyl)-2-oxo-1,3-diazinan-1-yl]-1-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[3-(2-ethoxy-2-oxoethyl)-2-oxo-1,3-diazinan-1-yl]piperidine-1-carboxylate Traditional Name: 4-[3-(2-ethoxy-2-keto-ethyl)-2-keto-hexahydropyrimidin-1-yl]piperidine-1-carboxylic acid benzyl ester Formula: C21H29N3O5 MolecularWeight: 403.47206

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H29N3O5/c1-2-28-19(25)15-23-11-6-12-24(20(23)26)18-9-13-22(14-10-18)21(27)29-16-17-7-4-3-5-8-17/h3-5,7-8,18H,2,6,9-16H2,1H3