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

Systemtic Name: ethyl 6-azanyl-5-cyano-4-[3-ethoxy-5-iodanyl-4-[(4-methylphenyl)methoxy]phenyl]-2-methyl-4H-pyran-3-carboxylate Openeye Name: ethyl 6-amino-5-cyano-4-[3-ethoxy-5-iodo-4-(p-tolylmethoxy)phenyl]-2-methyl-4H-pyran-3-carboxylate CAS Name: 6-amino-5-cyano-4-[3-ethoxy-5-iodo-4-[(4-methylphenyl)methoxy]phenyl]-2-methyl-4H-pyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-amino-5-cyano-4-[3-ethoxy-5-iodo-4-[(4-methylphenyl)methoxy]phenyl]-2-methyl-4H-pyran-3-carboxylate Traditional Name: 6-amino-5-cyano-4-[3-ethoxy-5-iodo-4-(4-methylbenzyl)oxy-phenyl]-2-methyl-4H-pyran-3-carboxylic acid ethyl ester Formula: C26H27IN2O5 MolecularWeight: 574.40745

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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)I)OCC3=CC=C(C=C3)C

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C2C(=C(OC(=C2C(=O)OCC)C)N)C#N)I)OCC3=CC=C(C=C3)C

InChI

InChI=1S/C26H27IN2O5/c1-5-31-21-12-18(11-20(27)24(21)33-14-17-9-7-15(3)8-10-17)23-19(13-28)25(29)34-16(4)22(23)26(30)32-6-2/h7-12,23H,5-6,14,29H2,1-4H3