2-azanyl-4-(3,5-dimethoxy-4-oxidanyl-phenyl)-5-oxidanylidene-4,6-dihydropyrano[3,2-c]quinoline-3-carbonitrile

Systemtic Name: 2-azanyl-4-(3,5-dimethoxy-4-oxidanyl-phenyl)-5-oxidanylidene-4,6-dihydropyrano[3,2-c]quinoline-3-carbonitrile Openeye Name: 2-amino-4-(4-hydroxy-3,5-dimethoxy-phenyl)-5-oxo-4,6-dihydropyrano[3,2-c]quinoline-3-carbonitrile CAS Name: 2-amino-4-(4-hydroxy-3,5-dimethoxyphenyl)-5-oxo-4,6-dihydropyrano[3,2-c]quinoline-3-carbonitrile IUPAC Name: 2-amino-4-(4-hydroxy-3,5-dimethoxyphenyl)-5-oxo-4,6-dihydropyrano[3,2-c]quinoline-3-carbonitrile Traditional Name: 2-amino-4-(4-hydroxy-3,5-dimethoxy-phenyl)-5-keto-4,6-dihydropyrano[3,2-c]quinoline-3-carbonitrile Formula: C21H17N3O5 MolecularWeight: 391.37678

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1O)OC)C2C(=C(OC3=C2C(=O)NC4=CC=CC=C43)N)C#N

Isomeric SMILES

COC1=CC(=CC(=C1O)OC)C2C(=C(OC3=C2C(=O)NC4=CC=CC=C43)N)C#N

InChI

InChI=1S/C21H17N3O5/c1-27-14-7-10(8-15(28-2)18(14)25)16-12(9-22)20(23)29-19-11-5-3-4-6-13(11)24-21(26)17(16)19/h3-8,16,25H,23H2,1-2H3,(H,24,26)