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

Systemtic Name: N-(1,3-benzodioxol-5-yl)-3-[2-(4-oxidanylidene-3H-phthalazin-1-yl)ethanoylamino]propanamide Openeye Name: N-(1,3-benzodioxol-5-yl)-3-[[2-(4-oxo-3H-phthalazin-1-yl)acetyl]amino]propanamide CAS Name: N-(1,3-benzodioxol-5-yl)-3-[[1-oxo-2-(4-oxo-3H-phthalazin-1-yl)ethyl]amino]propanamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-3-[[2-(4-oxo-3H-phthalazin-1-yl)acetyl]amino]propanamide Traditional Name: N-(1,3-benzodioxol-5-yl)-3-[[2-(4-keto-3H-phthalazin-1-yl)acetyl]amino]propionamide Formula: C20H18N4O5 MolecularWeight: 394.38072

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC(=O)CCNC(=O)CC3=NNC(=O)C4=CC=CC=C43

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NC(=O)CCNC(=O)CC3=NNC(=O)C4=CC=CC=C43

InChI

InChI=1S/C20H18N4O5/c25-18(22-12-5-6-16-17(9-12)29-11-28-16)7-8-21-19(26)10-15-13-3-1-2-4-14(13)20(27)24-23-15/h1-6,9H,7-8,10-11H2,(H,21,26)(H,22,25)(H,24,27)