phenyl 6-azanyl-5-cyano-4-(2-iodanylphenyl)-2-methyl-4H-pyran-3-carboxylate

Systemtic Name: phenyl 6-azanyl-5-cyano-4-(2-iodanylphenyl)-2-methyl-4H-pyran-3-carboxylate Openeye Name: phenyl 6-amino-5-cyano-4-(2-iodophenyl)-2-methyl-4H-pyran-3-carboxylate CAS Name: 6-amino-5-cyano-4-(2-iodophenyl)-2-methyl-4H-pyran-3-carboxylic acid phenyl ester IUPAC Name: phenyl 6-amino-5-cyano-4-(2-iodophenyl)-2-methyl-4H-pyran-3-carboxylate Traditional Name: 6-amino-5-cyano-4-(2-iodophenyl)-2-methyl-4H-pyran-3-carboxylic acid phenyl ester Formula: C20H15IN2O3 MolecularWeight: 458.24917

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(O1)N)C#N)C2=CC=CC=C2I)C(=O)OC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(C(=C(O1)N)C#N)C2=CC=CC=C2I)C(=O)OC3=CC=CC=C3

InChI

InChI=1S/C20H15IN2O3/c1-12-17(20(24)26-13-7-3-2-4-8-13)18(15(11-22)19(23)25-12)14-9-5-6-10-16(14)21/h2-10,18H,23H2,1H3