methyl (4S)-6-azanyl-5-cyano-4-(4-methoxycarbonylphenyl)-2-(methoxymethyl)-4H-pyran-3-carboxylate

Systemtic Name: methyl (4S)-6-azanyl-5-cyano-4-(4-methoxycarbonylphenyl)-2-(methoxymethyl)-4H-pyran-3-carboxylate Openeye Name: methyl (4S)-6-amino-5-cyano-4-(4-methoxycarbonylphenyl)-2-(methoxymethyl)-4H-pyran-3-carboxylate CAS Name: (4S)-6-amino-5-cyano-4-(4-methoxycarbonylphenyl)-2-(methoxymethyl)-4H-pyran-3-carboxylic acid methyl ester IUPAC Name: methyl (4S)-6-amino-5-cyano-4-(4-methoxycarbonylphenyl)-2-(methoxymethyl)-4H-pyran-3-carboxylate Traditional Name: (4S)-6-amino-4-(4-carbomethoxyphenyl)-5-cyano-2-(methoxymethyl)-4H-pyran-3-carboxylic acid methyl ester Formula: C18H18N2O6 MolecularWeight: 358.34532

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=C(C(C(=C(O1)N)C#N)C2=CC=C(C=C2)C(=O)OC)C(=O)OC

Isomeric SMILES

COCC1=C([C@H](C(=C(O1)N)C#N)C2=CC=C(C=C2)C(=O)OC)C(=O)OC

InChI

InChI=1S/C18H18N2O6/c1-23-9-13-15(18(22)25-3)14(12(8-19)16(20)26-13)10-4-6-11(7-5-10)17(21)24-2/h4-7,14H,9,20H2,1-3H3/t14-/m0/s1