ethyl 6-azanyl-5-cyano-4-[3-ethoxy-4-(2-methylpropoxy)phenyl]-2-methyl-4H-pyran-3-carboxylate

Systemtic Name: ethyl 6-azanyl-5-cyano-4-[3-ethoxy-4-(2-methylpropoxy)phenyl]-2-methyl-4H-pyran-3-carboxylate Openeye Name: ethyl 6-amino-5-cyano-4-(3-ethoxy-4-isobutoxy-phenyl)-2-methyl-4H-pyran-3-carboxylate CAS Name: 6-amino-5-cyano-4-[3-ethoxy-4-(2-methylpropoxy)phenyl]-2-methyl-4H-pyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-amino-5-cyano-4-[3-ethoxy-4-(2-methylpropoxy)phenyl]-2-methyl-4H-pyran-3-carboxylate Traditional Name: 6-amino-5-cyano-4-(3-ethoxy-4-isobutoxy-phenyl)-2-methyl-4H-pyran-3-carboxylic acid ethyl ester Formula: C22H28N2O5 MolecularWeight: 400.46812

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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)C

Isomeric SMILES

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

InChI

InChI=1S/C22H28N2O5/c1-6-26-18-10-15(8-9-17(18)28-12-13(3)4)20-16(11-23)21(24)29-14(5)19(20)22(25)27-7-2/h8-10,13,20H,6-7,12,24H2,1-5H3