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

Systemtic Name: prop-2-enyl (4S)-6-azanyl-5-cyano-2-methyl-4-(4-methylphenyl)-4H-pyran-3-carboxylate Openeye Name: allyl (4S)-6-amino-5-cyano-2-methyl-4-(p-tolyl)-4H-pyran-3-carboxylate CAS Name: (4S)-6-amino-5-cyano-2-methyl-4-(4-methylphenyl)-4H-pyran-3-carboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl (4S)-6-amino-5-cyano-2-methyl-4-(4-methylphenyl)-4H-pyran-3-carboxylate Traditional Name: (4S)-6-amino-5-cyano-2-methyl-4-(p-tolyl)-4H-pyran-3-carboxylic acid allyl ester Formula: C18H18N2O3 MolecularWeight: 310.34712

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18N2O3/c1-4-9-22-18(21)15-12(3)23-17(20)14(10-19)16(15)13-7-5-11(2)6-8-13/h4-8,16H,1,9,20H2,2-3H3/t16-/m0/s1