ethyl 6-azanyl-4-(1,3-benzodioxol-5-yl)-5-cyano-2-propyl-4H-pyran-3-carboxylate

Systemtic Name: ethyl 6-azanyl-4-(1,3-benzodioxol-5-yl)-5-cyano-2-propyl-4H-pyran-3-carboxylate Openeye Name: ethyl 6-amino-4-(1,3-benzodioxol-5-yl)-5-cyano-2-propyl-4H-pyran-3-carboxylate CAS Name: 6-amino-4-(1,3-benzodioxol-5-yl)-5-cyano-2-propyl-4H-pyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-amino-4-(1,3-benzodioxol-5-yl)-5-cyano-2-propyl-4H-pyran-3-carboxylate Traditional Name: 6-amino-4-(1,3-benzodioxol-5-yl)-5-cyano-2-propyl-4H-pyran-3-carboxylic acid ethyl ester Formula: C19H20N2O5 MolecularWeight: 356.3725

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(C(=C(O1)N)C#N)C2=CC3=C(C=C2)OCO3)C(=O)OCC

Isomeric SMILES

CCCC1=C(C(C(=C(O1)N)C#N)C2=CC3=C(C=C2)OCO3)C(=O)OCC

InChI

InChI=1S/C19H20N2O5/c1-3-5-14-17(19(22)23-4-2)16(12(9-20)18(21)26-14)11-6-7-13-15(8-11)25-10-24-13/h6-8,16H,3-5,10,21H2,1-2H3