ethyl 6-azanyl-4-[3-chloranyl-4-[(2-cyanophenyl)methoxy]-5-methoxy-phenyl]-5-cyano-2-methyl-4H-pyran-3-carboxylate

Systemtic Name: ethyl 6-azanyl-4-[3-chloranyl-4-[(2-cyanophenyl)methoxy]-5-methoxy-phenyl]-5-cyano-2-methyl-4H-pyran-3-carboxylate Openeye Name: ethyl 6-amino-4-[3-chloro-4-[(2-cyanophenyl)methoxy]-5-methoxy-phenyl]-5-cyano-2-methyl-4H-pyran-3-carboxylate CAS Name: 6-amino-4-[3-chloro-4-[(2-cyanophenyl)methoxy]-5-methoxyphenyl]-5-cyano-2-methyl-4H-pyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-amino-4-[3-chloro-4-[(2-cyanophenyl)methoxy]-5-methoxyphenyl]-5-cyano-2-methyl-4H-pyran-3-carboxylate Traditional Name: 6-amino-4-[3-chloro-4-(2-cyanobenzyl)oxy-5-methoxy-phenyl]-5-cyano-2-methyl-4H-pyran-3-carboxylic acid ethyl ester Formula: C25H22ClN3O5 MolecularWeight: 479.91228

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC(=C(C1C2=CC(=C(C(=C2)Cl)OCC3=CC=CC=C3C#N)OC)C#N)N)C

Isomeric SMILES

CCOC(=O)C1=C(OC(=C(C1C2=CC(=C(C(=C2)Cl)OCC3=CC=CC=C3C#N)OC)C#N)N)C

InChI

InChI=1S/C25H22ClN3O5/c1-4-32-25(30)21-14(2)34-24(29)18(12-28)22(21)17-9-19(26)23(20(10-17)31-3)33-13-16-8-6-5-7-15(16)11-27/h5-10,22H,4,13,29H2,1-3H3