tetraethyl 2-methyl-8,9-dihydropyridazino[1,6-a]azepine-6,7,8,9-tetracarboxylate

Systemtic Name: tetraethyl 2-methyl-8,9-dihydropyridazino[1,6-a]azepine-6,7,8,9-tetracarboxylate Openeye Name: tetraethyl 2-methyl-8,9-dihydropyridazino[1,6-a]azepine-6,7,8,9-tetracarboxylate CAS Name: 2-methyl-8,9-dihydropyridazino[1,6-a]azepine-6,7,8,9-tetracarboxylic acid tetraethyl ester IUPAC Name: tetraethyl 2-methyl-8,9-dihydropyridazino[1,6-a]azepine-6,7,8,9-tetracarboxylate Traditional Name: 2-methyl-8,9-dihydropyridazin[1,6-a]azepine-6,7,8,9-tetracarboxylic acid tetraethyl ester Formula: C22H28N2O8 MolecularWeight: 448.46632

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(N2C(=CC(=C1C(=O)OCC)C(=O)OCC)C=CC(=N2)C)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1C(N2C(=CC(=C1C(=O)OCC)C(=O)OCC)C=CC(=N2)C)C(=O)OCC

InChI

InChI=1S/C22H28N2O8/c1-6-29-19(25)15-12-14-11-10-13(5)23-24(14)18(22(28)32-9-4)17(21(27)31-8-3)16(15)20(26)30-7-2/h10-12,17-18H,6-9H2,1-5H3