prop-2-enyl (4S)-6-azanyl-4-(2-chloranyl-6-methyl-quinolin-3-yl)-5-cyano-2-methyl-4H-pyran-3-carboxylate

Systemtic Name: prop-2-enyl (4S)-6-azanyl-4-(2-chloranyl-6-methyl-quinolin-3-yl)-5-cyano-2-methyl-4H-pyran-3-carboxylate Openeye Name: allyl (4S)-6-amino-4-(2-chloro-6-methyl-3-quinolyl)-5-cyano-2-methyl-4H-pyran-3-carboxylate CAS Name: (4S)-6-amino-4-(2-chloro-6-methyl-3-quinolinyl)-5-cyano-2-methyl-4H-pyran-3-carboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl (4S)-6-amino-4-(2-chloro-6-methylquinolin-3-yl)-5-cyano-2-methyl-4H-pyran-3-carboxylate Traditional Name: (4S)-6-amino-4-(2-chloro-6-methyl-3-quinolyl)-5-cyano-2-methyl-4H-pyran-3-carboxylic acid allyl ester Formula: C21H18ClN3O3 MolecularWeight: 395.83892

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CC(=C(N=C2C=C1)Cl)C3C(=C(OC(=C3C(=O)OCC=C)C)N)C#N

Isomeric SMILES

CC1=CC2=CC(=C(N=C2C=C1)Cl)[C@H]3C(=C(OC(=C3C(=O)OCC=C)C)N)C#N

InChI

InChI=1S/C21H18ClN3O3/c1-4-7-27-21(26)17-12(3)28-20(24)15(10-23)18(17)14-9-13-8-11(2)5-6-16(13)25-19(14)22/h4-6,8-9,18H,1,7,24H2,2-3H3/t18-/m0/s1