ethyl (4S)-6-azanyl-2-(chloromethyl)-5-cyano-4-(4-methoxyphenyl)-4H-pyran-3-carboxylate

Systemtic Name: ethyl (4S)-6-azanyl-2-(chloromethyl)-5-cyano-4-(4-methoxyphenyl)-4H-pyran-3-carboxylate Openeye Name: ethyl (4S)-6-amino-2-(chloromethyl)-5-cyano-4-(4-methoxyphenyl)-4H-pyran-3-carboxylate CAS Name: (4S)-6-amino-2-(chloromethyl)-5-cyano-4-(4-methoxyphenyl)-4H-pyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl (4S)-6-amino-2-(chloromethyl)-5-cyano-4-(4-methoxyphenyl)-4H-pyran-3-carboxylate Traditional Name: (4S)-6-amino-2-(chloromethyl)-5-cyano-4-(4-methoxyphenyl)-4H-pyran-3-carboxylic acid ethyl ester Formula: C17H17ClN2O4 MolecularWeight: 348.78088

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC(=C(C1C2=CC=C(C=C2)OC)C#N)N)CCl

Isomeric SMILES

CCOC(=O)C1=C(OC(=C([C@@H]1C2=CC=C(C=C2)OC)C#N)N)CCl

InChI

InChI=1S/C17H17ClN2O4/c1-3-23-17(21)15-13(8-18)24-16(20)12(9-19)14(15)10-4-6-11(22-2)7-5-10/h4-7,14H,3,8,20H2,1-2H3/t14-/m0/s1