dimethyl 2-(6-oxidanylidene-2,4,7,8,9,10-hexahydroisochromeno[3,4-f][1,3]benzoxazin-3-yl)benzene-1,4-dicarboxylate

Systemtic Name: dimethyl 2-(6-oxidanylidene-2,4,7,8,9,10-hexahydroisochromeno[3,4-f][1,3]benzoxazin-3-yl)benzene-1,4-dicarboxylate Openeye Name: dimethyl 2-(6-oxo-2,4,7,8,9,10-hexahydroisochromeno[3,4-f][1,3]benzoxazin-3-yl)benzene-1,4-dicarboxylate CAS Name: 2-(6-oxo-2,4,7,8,9,10-hexahydro[2]benzopyrano[3,4-f][1,3]benzoxazin-3-yl)benzene-1,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-(6-oxo-2,4,7,8,9,10-hexahydroisochromeno[3,4-f][1,3]benzoxazin-3-yl)benzene-1,4-dicarboxylate Traditional Name: 2-(6-keto-2,4,7,8,9,10-hexahydroisochromeno[3,4-f][1,3]benzoxazin-3-yl)benzene-1,4-dicarboxylic acid dimethyl ester Formula: C25H23NO7 MolecularWeight: 449.45262

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)C(=O)OC)N2CC3=C(C=CC4=C3OC(=O)C5=C4CCCC5)OC2

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)C(=O)OC)N2CC3=C(C=CC4=C3OC(=O)C5=C4CCCC5)OC2

InChI

InChI=1S/C25H23NO7/c1-30-23(27)14-7-8-18(24(28)31-2)20(11-14)26-12-19-21(32-13-26)10-9-16-15-5-3-4-6-17(15)25(29)33-22(16)19/h7-11H,3-6,12-13H2,1-2H3