2-methoxyethyl (4S)-6-azanyl-4-(2-chloranyl-7-methyl-quinolin-3-yl)-5-cyano-2-methyl-4H-pyran-3-carboxylate

Systemtic Name: 2-methoxyethyl (4S)-6-azanyl-4-(2-chloranyl-7-methyl-quinolin-3-yl)-5-cyano-2-methyl-4H-pyran-3-carboxylate Openeye Name: 2-methoxyethyl (4S)-6-amino-4-(2-chloro-7-methyl-3-quinolyl)-5-cyano-2-methyl-4H-pyran-3-carboxylate CAS Name: (4S)-6-amino-4-(2-chloro-7-methyl-3-quinolinyl)-5-cyano-2-methyl-4H-pyran-3-carboxylic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl (4S)-6-amino-4-(2-chloro-7-methylquinolin-3-yl)-5-cyano-2-methyl-4H-pyran-3-carboxylate Traditional Name: (4S)-6-amino-4-(2-chloro-7-methyl-3-quinolyl)-5-cyano-2-methyl-4H-pyran-3-carboxylic acid 2-methoxyethyl ester Formula: C21H20ClN3O4 MolecularWeight: 413.8542

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NC(=C(C=C2C=C1)C3C(=C(OC(=C3C(=O)OCCOC)C)N)C#N)Cl

Isomeric SMILES

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

InChI

InChI=1S/C21H20ClN3O4/c1-11-4-5-13-9-14(19(22)25-16(13)8-11)18-15(10-23)20(24)29-12(2)17(18)21(26)28-7-6-27-3/h4-5,8-9,18H,6-7,24H2,1-3H3/t18-/m0/s1