4-(2-azanylquinolin-4-yl)oxy-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromene-6-carbonitrile

Systemtic Name: 4-(2-azanylquinolin-4-yl)oxy-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromene-6-carbonitrile Openeye Name: 4-[(2-amino-4-quinolyl)oxy]-3-hydroxy-2,2-dimethyl-chromane-6-carbonitrile CAS Name: 4-[(2-amino-4-quinolinyl)oxy]-3-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-6-carbonitrile IUPAC Name: 4-(2-aminoquinolin-4-yl)oxy-3-hydroxy-2,2-dimethyl-3,4-dihydrochromene-6-carbonitrile Traditional Name: 4-[(2-amino-4-quinolyl)oxy]-3-hydroxy-2,2-dimethyl-chroman-6-carbonitrile Formula: C21H19N3O3 MolecularWeight: 361.39386

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=CC(=C2)C#N)OC3=CC(=NC4=CC=CC=C43)N)O)C

Isomeric SMILES

CC1(C(C(C2=C(O1)C=CC(=C2)C#N)OC3=CC(=NC4=CC=CC=C43)N)O)C

InChI

InChI=1S/C21H19N3O3/c1-21(2)20(25)19(14-9-12(11-22)7-8-16(14)27-21)26-17-10-18(23)24-15-6-4-3-5-13(15)17/h3-10,19-20,25H,1-2H3,(H2,23,24)