ethyl 4-(4-azanyl-3-methoxy-phenyl)-5-cyano-2-(2-ethoxy-2-oxidanylidene-ethyl)-6-propoxy-4H-pyran-3-carboxylate

Systemtic Name: ethyl 4-(4-azanyl-3-methoxy-phenyl)-5-cyano-2-(2-ethoxy-2-oxidanylidene-ethyl)-6-propoxy-4H-pyran-3-carboxylate Openeye Name: ethyl 4-(4-amino-3-methoxy-phenyl)-5-cyano-2-(2-ethoxy-2-oxo-ethyl)-6-propoxy-4H-pyran-3-carboxylate CAS Name: 4-(4-amino-3-methoxyphenyl)-5-cyano-2-(2-ethoxy-2-oxoethyl)-6-propoxy-4H-pyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-amino-3-methoxyphenyl)-5-cyano-2-(2-ethoxy-2-oxoethyl)-6-propoxy-4H-pyran-3-carboxylate Traditional Name: 4-(4-amino-3-methoxy-phenyl)-5-cyano-2-(2-ethoxy-2-keto-ethyl)-6-propoxy-4H-pyran-3-carboxylic acid ethyl ester Formula: C23H28N2O7 MolecularWeight: 444.47762

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C(C(=C(O1)CC(=O)OCC)C(=O)OCC)C2=CC(=C(C=C2)N)OC)C#N

Isomeric SMILES

CCCOC1=C(C(C(=C(O1)CC(=O)OCC)C(=O)OCC)C2=CC(=C(C=C2)N)OC)C#N

InChI

InChI=1S/C23H28N2O7/c1-5-10-31-23-15(13-24)20(14-8-9-16(25)17(11-14)28-4)21(22(27)30-7-3)18(32-23)12-19(26)29-6-2/h8-9,11,20H,5-7,10,12,25H2,1-4H3