3-[2-[[2-(1,3-benzodioxol-5-ylmethylcarbamoyl)phenyl]amino]-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: 3-[2-[[2-(1,3-benzodioxol-5-ylmethylcarbamoyl)phenyl]amino]-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-[2-[2-(1,3-benzodioxol-5-ylmethylcarbamoyl)anilino]-2-oxo-ethyl]-4-oxo-phthalazine-1-carboxamide CAS Name: 3-[2-[2-[(1,3-benzodioxol-5-ylmethylamino)-oxomethyl]anilino]-2-oxoethyl]-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-[2-[2-(1,3-benzodioxol-5-ylmethylcarbamoyl)anilino]-2-oxoethyl]-4-oxophthalazine-1-carboxamide Traditional Name: 4-keto-3-[2-keto-2-[2-(piperonylcarbamoyl)anilino]ethyl]phthalazine-1-carboxamide Formula: C26H21N5O6 MolecularWeight: 499.47484

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=CC=CC=C3NC(=O)CN4C(=O)C5=CC=CC=C5C(=N4)C(=O)N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=CC=CC=C3NC(=O)CN4C(=O)C5=CC=CC=C5C(=N4)C(=O)N

InChI

InChI=1S/C26H21N5O6/c27-24(33)23-16-5-1-2-6-17(16)26(35)31(30-23)13-22(32)29-19-8-4-3-7-18(19)25(34)28-12-15-9-10-20-21(11-15)37-14-36-20/h1-11H,12-14H2,(H2,27,33)(H,28,34)(H,29,32)