3-[2-[(3,5-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxylate

Systemtic Name: 3-[2-[(3,5-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxylate Openeye Name: 3-[2-(3,5-dimethoxyanilino)-2-oxo-ethyl]-4-oxo-phthalazine-1-carboxylate CAS Name: 3-[2-(3,5-dimethoxyanilino)-2-oxoethyl]-4-oxo-1-phthalazinecarboxylate IUPAC Name: 3-[2-(3,5-dimethoxyanilino)-2-oxoethyl]-4-oxophthalazine-1-carboxylate Traditional Name: 3-[2-(3,5-dimethoxyanilino)-2-keto-ethyl]-4-keto-phthalazine-1-carboxylate Formula: C19H16N3O6- MolecularWeight: 382.34684

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)NC(=O)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)[O-])OC

Isomeric SMILES

COC1=CC(=CC(=C1)NC(=O)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)[O-])OC

InChI

InChI=1S/C19H17N3O6/c1-27-12-7-11(8-13(9-12)28-2)20-16(23)10-22-18(24)15-6-4-3-5-14(15)17(21-22)19(25)26/h3-9H,10H2,1-2H3,(H,20,23)(H,25,26)/p-1