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

Systemtic Name: methyl 6-azanyl-2-(chloromethyl)-5-cyano-4-(4-methoxycarbonylphenyl)-4H-pyran-3-carboxylate Openeye Name: methyl 6-amino-2-(chloromethyl)-5-cyano-4-(4-methoxycarbonylphenyl)-4H-pyran-3-carboxylate CAS Name: 6-amino-2-(chloromethyl)-5-cyano-4-(4-methoxycarbonylphenyl)-4H-pyran-3-carboxylic acid methyl ester IUPAC Name: methyl 6-amino-2-(chloromethyl)-5-cyano-4-(4-methoxycarbonylphenyl)-4H-pyran-3-carboxylate Traditional Name: 6-amino-4-(4-carbomethoxyphenyl)-2-(chloromethyl)-5-cyano-4H-pyran-3-carboxylic acid methyl ester Formula: C17H15ClN2O5 MolecularWeight: 362.7644

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C2C(=C(OC(=C2C(=O)OC)CCl)N)C#N

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C2C(=C(OC(=C2C(=O)OC)CCl)N)C#N

InChI

InChI=1S/C17H15ClN2O5/c1-23-16(21)10-5-3-9(4-6-10)13-11(8-19)15(20)25-12(7-18)14(13)17(22)24-2/h3-6,13H,7,20H2,1-2H3