3-[2-[(4-ethoxycarbonylphenyl)amino]-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxylate

Systemtic Name: 3-[2-[(4-ethoxycarbonylphenyl)amino]-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxylate Openeye Name: 3-[2-(4-ethoxycarbonylanilino)-2-oxo-ethyl]-4-oxo-phthalazine-1-carboxylate CAS Name: 3-[2-(4-ethoxycarbonylanilino)-2-oxoethyl]-4-oxo-1-phthalazinecarboxylate IUPAC Name: 3-[2-(4-ethoxycarbonylanilino)-2-oxoethyl]-4-oxophthalazine-1-carboxylate Traditional Name: 3-[2-(4-carbethoxyanilino)-2-keto-ethyl]-4-keto-phthalazine-1-carboxylate Formula: C20H16N3O6- MolecularWeight: 394.35754

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H17N3O6/c1-2-29-20(28)12-7-9-13(10-8-12)21-16(24)11-23-18(25)15-6-4-3-5-14(15)17(22-23)19(26)27/h3-10H,2,11H2,1H3,(H,21,24)(H,26,27)/p-1