tert-butyl 6-azanyl-4-(2-chloranyl-8-methyl-quinolin-3-yl)-5-cyano-2-methyl-4H-pyran-3-carboxylate

Systemtic Name: tert-butyl 6-azanyl-4-(2-chloranyl-8-methyl-quinolin-3-yl)-5-cyano-2-methyl-4H-pyran-3-carboxylate Openeye Name: tert-butyl 6-amino-4-(2-chloro-8-methyl-3-quinolyl)-5-cyano-2-methyl-4H-pyran-3-carboxylate CAS Name: 6-amino-4-(2-chloro-8-methyl-3-quinolinyl)-5-cyano-2-methyl-4H-pyran-3-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 6-amino-4-(2-chloro-8-methylquinolin-3-yl)-5-cyano-2-methyl-4H-pyran-3-carboxylate Traditional Name: 6-amino-4-(2-chloro-8-methyl-3-quinolyl)-5-cyano-2-methyl-4H-pyran-3-carboxylic acid tert-butyl ester Formula: C22H22ClN3O3 MolecularWeight: 411.88138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=CC(=C(N=C12)Cl)C3C(=C(OC(=C3C(=O)OC(C)(C)C)C)N)C#N

Isomeric SMILES

CC1=CC=CC2=CC(=C(N=C12)Cl)C3C(=C(OC(=C3C(=O)OC(C)(C)C)C)N)C#N

InChI

InChI=1S/C22H22ClN3O3/c1-11-7-6-8-13-9-14(19(23)26-18(11)13)17-15(10-24)20(25)28-12(2)16(17)21(27)29-22(3,4)5/h6-9,17H,25H2,1-5H3