4-[[1,4-bis(oxidanylidene)-2,3-dihydrophthalazin-6-yl]amino]-6,7-diethoxy-quinoline-3-carbonitrile

Systemtic Name: 4-[[1,4-bis(oxidanylidene)-2,3-dihydrophthalazin-6-yl]amino]-6,7-diethoxy-quinoline-3-carbonitrile Openeye Name: 4-[(1,4-dioxo-2,3-dihydrophthalazin-6-yl)amino]-6,7-diethoxy-quinoline-3-carbonitrile CAS Name: 4-[(1,4-dioxo-2,3-dihydrophthalazin-6-yl)amino]-6,7-diethoxy-3-quinolinecarbonitrile IUPAC Name: 4-[(1,4-dioxo-2,3-dihydrophthalazin-6-yl)amino]-6,7-diethoxyquinoline-3-carbonitrile Traditional Name: 4-[(1,4-diketo-2,3-dihydrophthalazin-6-yl)amino]-6,7-diethoxy-quinoline-3-carbonitrile Formula: C22H19N5O4 MolecularWeight: 417.41736

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)C(=C(C=N2)C#N)NC3=CC4=C(C=C3)C(=O)NNC4=O)OCC

Isomeric SMILES

CCOC1=C(C=C2C(=C1)C(=C(C=N2)C#N)NC3=CC4=C(C=C3)C(=O)NNC4=O)OCC

InChI

InChI=1S/C22H19N5O4/c1-3-30-18-8-16-17(9-19(18)31-4-2)24-11-12(10-23)20(16)25-13-5-6-14-15(7-13)22(29)27-26-21(14)28/h5-9,11H,3-4H2,1-2H3,(H,24,25)(H,26,28)(H,27,29)