methyl 4-(5-chloranyl-2-oxidanyl-phenyl)-2-methyl-5-oxidanylidene-1,4,6,7-tetrahydrocyclopenta[b]pyridine-3-carboxylate

Systemtic Name: methyl 4-(5-chloranyl-2-oxidanyl-phenyl)-2-methyl-5-oxidanylidene-1,4,6,7-tetrahydrocyclopenta[b]pyridine-3-carboxylate Openeye Name: methyl 4-(5-chloro-2-hydroxy-phenyl)-2-methyl-5-oxo-1,4,6,7-tetrahydrocyclopenta[b]pyridine-3-carboxylate CAS Name: 4-(5-chloro-2-hydroxyphenyl)-2-methyl-5-oxo-1,4,6,7-tetrahydrocyclopenta[b]pyridine-3-carboxylic acid methyl ester IUPAC Name: methyl 4-(5-chloro-2-hydroxyphenyl)-2-methyl-5-oxo-1,4,6,7-tetrahydrocyclopenta[b]pyridine-3-carboxylate Traditional Name: 4-(5-chloro-2-hydroxy-phenyl)-5-keto-2-methyl-1,4,6,7-tetrahydro-1-pyrindine-3-carboxylic acid methyl ester Formula: C17H16ClNO4 MolecularWeight: 333.76624

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C2=C(N1)CCC2=O)C3=C(C=CC(=C3)Cl)O)C(=O)OC

Isomeric SMILES

CC1=C(C(C2=C(N1)CCC2=O)C3=C(C=CC(=C3)Cl)O)C(=O)OC

InChI

InChI=1S/C17H16ClNO4/c1-8-14(17(22)23-2)15(10-7-9(18)3-5-12(10)20)16-11(19-8)4-6-13(16)21/h3,5,7,15,19-20H,4,6H2,1-2H3