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

Systemtic Name: N-(1,3-benzodioxol-5-yl)-3-hexyl-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-(1,3-benzodioxol-5-yl)-3-hexyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-(1,3-benzodioxol-5-yl)-3-hexyl-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-3-hexyl-4-oxophthalazine-1-carboxamide Traditional Name: N-(1,3-benzodioxol-5-yl)-3-hexyl-4-keto-phthalazine-1-carboxamide Formula: C22H23N3O4 MolecularWeight: 393.43572

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C22H23N3O4/c1-2-3-4-7-12-25-22(27)17-9-6-5-8-16(17)20(24-25)21(26)23-15-10-11-18-19(13-15)29-14-28-18/h5-6,8-11,13H,2-4,7,12,14H2,1H3,(H,23,26)