N-[1-[(E)-3-(4-nitrophenyl)prop-2-enyl]-4-oxidanylidene-3H-phthalazin-6-yl]furan-2-carboxamide

Systemtic Name: N-[1-[(E)-3-(4-nitrophenyl)prop-2-enyl]-4-oxidanylidene-3H-phthalazin-6-yl]furan-2-carboxamide Openeye Name: N-[1-[(E)-3-(4-nitrophenyl)allyl]-4-oxo-3H-phthalazin-6-yl]furan-2-carboxamide CAS Name: N-[1-[(E)-3-(4-nitrophenyl)prop-2-enyl]-4-oxo-3H-phthalazin-6-yl]-2-furancarboxamide IUPAC Name: N-[1-[(E)-3-(4-nitrophenyl)prop-2-enyl]-4-oxo-3H-phthalazin-6-yl]furan-2-carboxamide Traditional Name: N-[4-keto-1-[(E)-3-(4-nitrophenyl)allyl]-3H-phthalazin-6-yl]-2-furamide Formula: C22H16N4O5 MolecularWeight: 416.38624

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)C(=O)NC2=CC3=C(C=C2)C(=NNC3=O)CC=CC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=COC(=C1)C(=O)NC2=CC3=C(C=C2)C(=NNC3=O)C/C=C/C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H16N4O5/c27-21-18-13-15(23-22(28)20-5-2-12-31-20)8-11-17(18)19(24-25-21)4-1-3-14-6-9-16(10-7-14)26(29)30/h1-3,5-13H,4H2,(H,23,28)(H,25,27)/b3-1+