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

Systemtic Name: 4-[[2,4-bis(oxidanylidene)-1,3-benzoxazin-6-yl]amino]-6,7-diethoxy-quinoline-3-carbonitrile Openeye Name: 4-[(2,4-dioxo-1,3-benzoxazin-6-yl)amino]-6,7-diethoxy-quinoline-3-carbonitrile CAS Name: 4-[(2,4-dioxo-1,3-benzoxazin-6-yl)amino]-6,7-diethoxy-3-quinolinecarbonitrile IUPAC Name: 4-[(2,4-dioxo-1,3-benzoxazin-6-yl)amino]-6,7-diethoxyquinoline-3-carbonitrile Traditional Name: 4-[(2,4-diketo-1,3-benzoxazin-6-yl)amino]-6,7-diethoxy-quinoline-3-carbonitrile Formula: C22H18N4O5 MolecularWeight: 418.40212

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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)OC(=O)NC4=O)OCC

Isomeric SMILES

CCOC1=C(C=C2C(=C1)C(=C(C=N2)C#N)NC3=CC4=C(C=C3)OC(=O)NC4=O)OCC

InChI

InChI=1S/C22H18N4O5/c1-3-29-18-8-14-16(9-19(18)30-4-2)24-11-12(10-23)20(14)25-13-5-6-17-15(7-13)21(27)26-22(28)31-17/h5-9,11H,3-4H2,1-2H3,(H,24,25)(H,26,27,28)