N-[(Z)-(7-methoxy-1,3-benzodioxol-5-yl)methylideneamino]-4-oxidanylidene-3H-phthalazine-1-carboxamide

Systemtic Name: N-[(Z)-(7-methoxy-1,3-benzodioxol-5-yl)methylideneamino]-4-oxidanylidene-3H-phthalazine-1-carboxamide Openeye Name: N-[(Z)-(7-methoxy-1,3-benzodioxol-5-yl)methyleneamino]-4-oxo-3H-phthalazine-1-carboxamide CAS Name: N-[(Z)-(7-methoxy-1,3-benzodioxol-5-yl)methylideneamino]-4-oxo-3H-phthalazine-1-carboxamide IUPAC Name: N-[(Z)-(7-methoxy-1,3-benzodioxol-5-yl)methylideneamino]-4-oxo-3H-phthalazine-1-carboxamide Traditional Name: 4-keto-N-[(Z)-(7-methoxy-1,3-benzodioxol-5-yl)methyleneamino]-3H-phthalazine-1-carboxamide Formula: C18H14N4O5 MolecularWeight: 366.32756

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC2=C1OCO2)C=NNC(=O)C3=NNC(=O)C4=CC=CC=C43

Isomeric SMILES

COC1=CC(=CC2=C1OCO2)/C=N\NC(=O)C3=NNC(=O)C4=CC=CC=C43

InChI

InChI=1S/C18H14N4O5/c1-25-13-6-10(7-14-16(13)27-9-26-14)8-19-21-18(24)15-11-4-2-3-5-12(11)17(23)22-20-15/h2-8H,9H2,1H3,(H,21,24)(H,22,23)/b19-8-