diethyl 6,7,8,9-tetrahydro-5H-pyrimido[4,5-b]azepine-2,4-dicarboxylate

Systemtic Name: diethyl 6,7,8,9-tetrahydro-5H-pyrimido[4,5-b]azepine-2,4-dicarboxylate Openeye Name: diethyl 6,7,8,9-tetrahydro-5H-pyrimido[4,5-b]azepine-2,4-dicarboxylate CAS Name: 6,7,8,9-tetrahydro-5H-pyrimido[4,5-b]azepine-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 6,7,8,9-tetrahydro-5H-pyrimido[4,5-b]azepine-2,4-dicarboxylate Traditional Name: 6,7,8,9-tetrahydro-5H-pyrimid[4,5-b]azepine-2,4-dicarboxylic acid diethyl ester Formula: C14H19N3O4 MolecularWeight: 293.31836

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2CCCCNC2=NC(=N1)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=C2CCCCNC2=NC(=N1)C(=O)OCC

InChI

InChI=1S/C14H19N3O4/c1-3-20-13(18)10-9-7-5-6-8-15-11(9)17-12(16-10)14(19)21-4-2/h3-8H2,1-2H3,(H,15,16,17)