3-[1,4-bis(oxidanylidene)-3H-phthalazin-2-yl]-N-(6-ethanoyl-1,3-benzodioxol-5-yl)propanamide

Systemtic Name: 3-[1,4-bis(oxidanylidene)-3H-phthalazin-2-yl]-N-(6-ethanoyl-1,3-benzodioxol-5-yl)propanamide Openeye Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-3-(1,4-dioxo-3H-phthalazin-2-yl)propanamide CAS Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-3-(1,4-dioxo-3H-phthalazin-2-yl)propanamide IUPAC Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-3-(1,4-dioxo-3H-phthalazin-2-yl)propanamide Traditional Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-3-(1,4-diketo-3H-phthalazin-2-yl)propionamide Formula: C20H17N3O6 MolecularWeight: 395.36548

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1NC(=O)CCN3C(=O)C4=CC=CC=C4C(=O)N3)OCO2

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1NC(=O)CCN3C(=O)C4=CC=CC=C4C(=O)N3)OCO2

InChI

InChI=1S/C20H17N3O6/c1-11(24)14-8-16-17(29-10-28-16)9-15(14)21-18(25)6-7-23-20(27)13-5-3-2-4-12(13)19(26)22-23/h2-5,8-9H,6-7,10H2,1H3,(H,21,25)(H,22,26)