N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(1-oxidanylidene-4-phenyl-5,6,7,8-tetrahydrophthalazin-2-yl)butanamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(1-oxidanylidene-4-phenyl-5,6,7,8-tetrahydrophthalazin-2-yl)butanamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(1-oxo-4-phenyl-5,6,7,8-tetrahydrophthalazin-2-yl)butanamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(1-oxo-4-phenyl-5,6,7,8-tetrahydrophthalazin-2-yl)butanamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(1-oxo-4-phenyl-5,6,7,8-tetrahydrophthalazin-2-yl)butanamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(1-keto-4-phenyl-5,6,7,8-tetrahydrophthalazin-2-yl)butyramide Formula: C26H27N3O4 MolecularWeight: 445.51028

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC2=C(C=C1)OCCO2)N3C(=O)C4=C(CCCC4)C(=N3)C5=CC=CC=C5

Isomeric SMILES

CCC(C(=O)NC1=CC2=C(C=C1)OCCO2)N3C(=O)C4=C(CCCC4)C(=N3)C5=CC=CC=C5

InChI

InChI=1S/C26H27N3O4/c1-2-21(25(30)27-18-12-13-22-23(16-18)33-15-14-32-22)29-26(31)20-11-7-6-10-19(20)24(28-29)17-8-4-3-5-9-17/h3-5,8-9,12-13,16,21H,2,6-7,10-11,14-15H2,1H3,(H,27,30)