3-[1,4-bis(oxidanylidene)-3H-phthalazin-2-yl]-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)propanamide

Systemtic Name: 3-[1,4-bis(oxidanylidene)-3H-phthalazin-2-yl]-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)propanamide Openeye Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-(1,4-dioxo-3H-phthalazin-2-yl)propanamide CAS Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-(1,4-dioxo-3H-phthalazin-2-yl)propanamide IUPAC Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-(1,4-dioxo-3H-phthalazin-2-yl)propanamide Traditional Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-(1,4-diketo-3H-phthalazin-2-yl)propionamide Formula: C20H19N3O5 MolecularWeight: 381.38196

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)NC(=O)CCN3C(=O)C4=CC=CC=C4C(=O)N3)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)NC(=O)CCN3C(=O)C4=CC=CC=C4C(=O)N3)OC1

InChI

InChI=1S/C20H19N3O5/c24-18(21-13-6-7-16-17(12-13)28-11-3-10-27-16)8-9-23-20(26)15-5-2-1-4-14(15)19(25)22-23/h1-2,4-7,12H,3,8-11H2,(H,21,24)(H,22,25)