ethyl 2-[4-(3,4-dimethoxyphenyl)-1-oxidanylidene-4a,5,8,8a-tetrahydrophthalazin-2-yl]ethanoate

Systemtic Name: ethyl 2-[4-(3,4-dimethoxyphenyl)-1-oxidanylidene-4a,5,8,8a-tetrahydrophthalazin-2-yl]ethanoate Openeye Name: ethyl 2-[4-(3,4-dimethoxyphenyl)-1-oxo-4a,5,8,8a-tetrahydrophthalazin-2-yl]acetate CAS Name: 2-[4-(3,4-dimethoxyphenyl)-1-oxo-4a,5,8,8a-tetrahydrophthalazin-2-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-(3,4-dimethoxyphenyl)-1-oxo-4a,5,8,8a-tetrahydrophthalazin-2-yl]acetate Traditional Name: 2-[4-(3,4-dimethoxyphenyl)-1-keto-4a,5,8,8a-tetrahydrophthalazin-2-yl]acetic acid ethyl ester Formula: C20H24N2O5 MolecularWeight: 372.41496

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C(=O)C2CC=CCC2C(=N1)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CCOC(=O)CN1C(=O)C2CC=CCC2C(=N1)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C20H24N2O5/c1-4-27-18(23)12-22-20(24)15-8-6-5-7-14(15)19(21-22)13-9-10-16(25-2)17(11-13)26-3/h5-6,9-11,14-15H,4,7-8,12H2,1-3H3