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

Systemtic Name: N-(1,3-benzodioxol-5-yl)-3-(2-methylpropyl)-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-(1,3-benzodioxol-5-yl)-3-isobutyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-(1,3-benzodioxol-5-yl)-3-(2-methylpropyl)-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-3-(2-methylpropyl)-4-oxophthalazine-1-carboxamide Traditional Name: N-(1,3-benzodioxol-5-yl)-3-isobutyl-4-keto-phthalazine-1-carboxamide Formula: C20H19N3O4 MolecularWeight: 365.38256

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC(C)CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H19N3O4/c1-12(2)10-23-20(25)15-6-4-3-5-14(15)18(22-23)19(24)21-13-7-8-16-17(9-13)27-11-26-16/h3-9,12H,10-11H2,1-2H3,(H,21,24)