ethyl 6-azanyl-5-cyano-4-(3-ethoxy-4-prop-2-ynoxy-phenyl)-2-methyl-4H-pyran-3-carboxylate

Systemtic Name: ethyl 6-azanyl-5-cyano-4-(3-ethoxy-4-prop-2-ynoxy-phenyl)-2-methyl-4H-pyran-3-carboxylate Openeye Name: ethyl 6-amino-5-cyano-4-(3-ethoxy-4-prop-2-ynoxy-phenyl)-2-methyl-4H-pyran-3-carboxylate CAS Name: 6-amino-5-cyano-4-(3-ethoxy-4-prop-2-ynoxyphenyl)-2-methyl-4H-pyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-amino-5-cyano-4-(3-ethoxy-4-prop-2-ynoxyphenyl)-2-methyl-4H-pyran-3-carboxylate Traditional Name: 6-amino-5-cyano-4-(3-ethoxy-4-propargyloxy-phenyl)-2-methyl-4H-pyran-3-carboxylic acid ethyl ester Formula: C21H22N2O5 MolecularWeight: 382.40978

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C2C(=C(OC(=C2C(=O)OCC)C)N)C#N)OCC#C

Isomeric SMILES

CCOC1=C(C=CC(=C1)C2C(=C(OC(=C2C(=O)OCC)C)N)C#N)OCC#C

InChI

InChI=1S/C21H22N2O5/c1-5-10-27-16-9-8-14(11-17(16)25-6-2)19-15(12-22)20(23)28-13(4)18(19)21(24)26-7-3/h1,8-9,11,19H,6-7,10,23H2,2-4H3