3-[2-[(4-chloranyl-2,5-dimethoxy-phenyl)amino]-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: 3-[2-[(4-chloranyl-2,5-dimethoxy-phenyl)amino]-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-[2-(4-chloro-2,5-dimethoxy-anilino)-2-oxo-ethyl]-4-oxo-phthalazine-1-carboxamide CAS Name: 3-[2-(4-chloro-2,5-dimethoxyanilino)-2-oxoethyl]-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-[2-(4-chloro-2,5-dimethoxyanilino)-2-oxoethyl]-4-oxophthalazine-1-carboxamide Traditional Name: 3-[2-(4-chloro-2,5-dimethoxy-anilino)-2-keto-ethyl]-4-keto-phthalazine-1-carboxamide Formula: C19H17ClN4O5 MolecularWeight: 416.81508

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=O)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)N)OC)Cl

Isomeric SMILES

COC1=CC(=C(C=C1NC(=O)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)N)OC)Cl

InChI

InChI=1S/C19H17ClN4O5/c1-28-14-8-13(15(29-2)7-12(14)20)22-16(25)9-24-19(27)11-6-4-3-5-10(11)17(23-24)18(21)26/h3-8H,9H2,1-2H3,(H2,21,26)(H,22,25)