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

Systemtic Name: N-(1,3-benzodioxol-5-yl)-4-oxidanylidene-3-pentyl-phthalazine-1-carboxamide Openeye Name: N-(1,3-benzodioxol-5-yl)-4-oxo-3-pentyl-phthalazine-1-carboxamide CAS Name: N-(1,3-benzodioxol-5-yl)-4-oxo-3-pentyl-1-phthalazinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-4-oxo-3-pentylphthalazine-1-carboxamide Traditional Name: 3-amyl-N-(1,3-benzodioxol-5-yl)-4-keto-phthalazine-1-carboxamide Formula: C21H21N3O4 MolecularWeight: 379.40914

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H21N3O4/c1-2-3-6-11-24-21(26)16-8-5-4-7-15(16)19(23-24)20(25)22-14-9-10-17-18(12-14)28-13-27-17/h4-5,7-10,12H,2-3,6,11,13H2,1H3,(H,22,25)