3-(3,5-dimethoxyphenyl)-N-(furan-2-ylmethyl)-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: 3-(3,5-dimethoxyphenyl)-N-(furan-2-ylmethyl)-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-(3,5-dimethoxyphenyl)-N-(2-furylmethyl)-4-oxo-phthalazine-1-carboxamide CAS Name: 3-(3,5-dimethoxyphenyl)-N-(2-furanylmethyl)-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-(3,5-dimethoxyphenyl)-N-(furan-2-ylmethyl)-4-oxophthalazine-1-carboxamide Traditional Name: 3-(3,5-dimethoxyphenyl)-N-(2-furfuryl)-4-keto-phthalazine-1-carboxamide Formula: C22H19N3O5 MolecularWeight: 405.40336

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)NCC4=CC=CO4)OC

Isomeric SMILES

COC1=CC(=CC(=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)NCC4=CC=CO4)OC

InChI

InChI=1S/C22H19N3O5/c1-28-16-10-14(11-17(12-16)29-2)25-22(27)19-8-4-3-7-18(19)20(24-25)21(26)23-13-15-6-5-9-30-15/h3-12H,13H2,1-2H3,(H,23,26)