3-(2-methylpropyl)-4-oxidanylidene-N-(3,4,5-trimethoxyphenyl)phthalazine-1-carboxamide

Systemtic Name: 3-(2-methylpropyl)-4-oxidanylidene-N-(3,4,5-trimethoxyphenyl)phthalazine-1-carboxamide Openeye Name: 3-isobutyl-4-oxo-N-(3,4,5-trimethoxyphenyl)phthalazine-1-carboxamide CAS Name: 3-(2-methylpropyl)-4-oxo-N-(3,4,5-trimethoxyphenyl)-1-phthalazinecarboxamide IUPAC Name: 3-(2-methylpropyl)-4-oxo-N-(3,4,5-trimethoxyphenyl)phthalazine-1-carboxamide Traditional Name: 3-isobutyl-4-keto-N-(3,4,5-trimethoxyphenyl)phthalazine-1-carboxamide Formula: C22H25N3O5 MolecularWeight: 411.451

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC(=C(C(=C3)OC)OC)OC

Isomeric SMILES

CC(C)CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC(=C(C(=C3)OC)OC)OC

InChI

InChI=1S/C22H25N3O5/c1-13(2)12-25-22(27)16-9-7-6-8-15(16)19(24-25)21(26)23-14-10-17(28-3)20(30-5)18(11-14)29-4/h6-11,13H,12H2,1-5H3,(H,23,26)