N-(1,3-benzodioxol-5-yl)-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxamide Openeye Name: N-(1,3-benzodioxol-5-yl)-3-benzyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-(1,3-benzodioxol-5-yl)-4-oxo-3-(phenylmethyl)-1-phthalazinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-3-benzyl-4-oxophthalazine-1-carboxamide Traditional Name: N-(1,3-benzodioxol-5-yl)-3-benzyl-4-keto-phthalazine-1-carboxamide Formula: C23H17N3O4 MolecularWeight: 399.39878

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC(=O)C3=NN(C(=O)C4=CC=CC=C43)CC5=CC=CC=C5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NC(=O)C3=NN(C(=O)C4=CC=CC=C43)CC5=CC=CC=C5

InChI

InChI=1S/C23H17N3O4/c27-22(24-16-10-11-19-20(12-16)30-14-29-19)21-17-8-4-5-9-18(17)23(28)26(25-21)13-15-6-2-1-3-7-15/h1-12H,13-14H2,(H,24,27)