ethyl 6-azanyl-5-cyano-2-methyl-4-[2-(4-methylphenyl)sulfonyloxyphenyl]-4H-pyran-3-carboxylate

Systemtic Name: ethyl 6-azanyl-5-cyano-2-methyl-4-[2-(4-methylphenyl)sulfonyloxyphenyl]-4H-pyran-3-carboxylate Openeye Name: ethyl 6-amino-5-cyano-2-methyl-4-[2-(p-tolylsulfonyloxy)phenyl]-4H-pyran-3-carboxylate CAS Name: 6-amino-5-cyano-2-methyl-4-[2-(4-methylphenyl)sulfonyloxyphenyl]-4H-pyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-amino-5-cyano-2-methyl-4-[2-(4-methylphenyl)sulfonyloxyphenyl]-4H-pyran-3-carboxylate Traditional Name: 6-amino-5-cyano-2-methyl-4-(2-tosyloxyphenyl)-4H-pyran-3-carboxylic acid ethyl ester Formula: C23H22N2O6S MolecularWeight: 454.49558

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC(=C(C1C2=CC=CC=C2OS(=O)(=O)C3=CC=C(C=C3)C)C#N)N)C

Isomeric SMILES

CCOC(=O)C1=C(OC(=C(C1C2=CC=CC=C2OS(=O)(=O)C3=CC=C(C=C3)C)C#N)N)C

InChI

InChI=1S/C23H22N2O6S/c1-4-29-23(26)20-15(3)30-22(25)18(13-24)21(20)17-7-5-6-8-19(17)31-32(27,28)16-11-9-14(2)10-12-16/h5-12,21H,4,25H2,1-3H3