N-[4-[3-[1,4-bis(oxidanylidene)-3H-phthalazin-2-yl]propanoylamino]phenyl]furan-2-carboxamide

Systemtic Name: N-[4-[3-[1,4-bis(oxidanylidene)-3H-phthalazin-2-yl]propanoylamino]phenyl]furan-2-carboxamide Openeye Name: N-[4-[3-(1,4-dioxo-3H-phthalazin-2-yl)propanoylamino]phenyl]furan-2-carboxamide CAS Name: N-[4-[[3-(1,4-dioxo-3H-phthalazin-2-yl)-1-oxopropyl]amino]phenyl]-2-furancarboxamide IUPAC Name: N-[4-[3-(1,4-dioxo-3H-phthalazin-2-yl)propanoylamino]phenyl]furan-2-carboxamide Traditional Name: N-[4-[3-(1,4-diketo-3H-phthalazin-2-yl)propanoylamino]phenyl]-2-furamide Formula: C22H18N4O5 MolecularWeight: 418.40212

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)NN(C2=O)CCC(=O)NC3=CC=C(C=C3)NC(=O)C4=CC=CO4

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)NN(C2=O)CCC(=O)NC3=CC=C(C=C3)NC(=O)C4=CC=CO4

InChI

InChI=1S/C22H18N4O5/c27-19(11-12-26-22(30)17-5-2-1-4-16(17)20(28)25-26)23-14-7-9-15(10-8-14)24-21(29)18-6-3-13-31-18/h1-10,13H,11-12H2,(H,23,27)(H,24,29)(H,25,28)