tert-butyl (4S)-6-azanyl-5-cyano-2-methyl-4-(2-methylphenyl)-4H-pyran-3-carboxylate

Systemtic Name: tert-butyl (4S)-6-azanyl-5-cyano-2-methyl-4-(2-methylphenyl)-4H-pyran-3-carboxylate Openeye Name: tert-butyl (4S)-6-amino-5-cyano-2-methyl-4-(o-tolyl)-4H-pyran-3-carboxylate CAS Name: (4S)-6-amino-5-cyano-2-methyl-4-(2-methylphenyl)-4H-pyran-3-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl (4S)-6-amino-5-cyano-2-methyl-4-(2-methylphenyl)-4H-pyran-3-carboxylate Traditional Name: (4S)-6-amino-5-cyano-2-methyl-4-(o-tolyl)-4H-pyran-3-carboxylic acid tert-butyl ester Formula: C19H22N2O3 MolecularWeight: 326.38958

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2C(=C(OC(=C2C(=O)OC(C)(C)C)C)N)C#N

Isomeric SMILES

CC1=CC=CC=C1[C@H]2C(=C(OC(=C2C(=O)OC(C)(C)C)C)N)C#N

InChI

InChI=1S/C19H22N2O3/c1-11-8-6-7-9-13(11)16-14(10-20)17(21)23-12(2)15(16)18(22)24-19(3,4)5/h6-9,16H,21H2,1-5H3/t16-/m0/s1