ethyl 6-azanyl-2-(chloromethyl)-5-cyano-4-(2,4,5-trimethoxyphenyl)-4H-pyran-3-carboxylate

Systemtic Name: ethyl 6-azanyl-2-(chloromethyl)-5-cyano-4-(2,4,5-trimethoxyphenyl)-4H-pyran-3-carboxylate Openeye Name: ethyl 6-amino-2-(chloromethyl)-5-cyano-4-(2,4,5-trimethoxyphenyl)-4H-pyran-3-carboxylate CAS Name: 6-amino-2-(chloromethyl)-5-cyano-4-(2,4,5-trimethoxyphenyl)-4H-pyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-amino-2-(chloromethyl)-5-cyano-4-(2,4,5-trimethoxyphenyl)-4H-pyran-3-carboxylate Traditional Name: 6-amino-4-asaryl-2-(chloromethyl)-5-cyano-4H-pyran-3-carboxylic acid ethyl ester Formula: C19H21ClN2O6 MolecularWeight: 408.83284

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC(=C(C1C2=CC(=C(C=C2OC)OC)OC)C#N)N)CCl

Isomeric SMILES

CCOC(=O)C1=C(OC(=C(C1C2=CC(=C(C=C2OC)OC)OC)C#N)N)CCl

InChI

InChI=1S/C19H21ClN2O6/c1-5-27-19(23)17-15(8-20)28-18(22)11(9-21)16(17)10-6-13(25-3)14(26-4)7-12(10)24-2/h6-7,16H,5,8,22H2,1-4H3