dimethyl 4-(3-chloranyl-5-methoxy-4-oxidanyl-phenyl)-1-cyclopentyl-4H-pyridine-3,5-dicarboxylate

Systemtic Name: dimethyl 4-(3-chloranyl-5-methoxy-4-oxidanyl-phenyl)-1-cyclopentyl-4H-pyridine-3,5-dicarboxylate Openeye Name: dimethyl 4-(3-chloro-4-hydroxy-5-methoxy-phenyl)-1-cyclopentyl-4H-pyridine-3,5-dicarboxylate CAS Name: 4-(3-chloro-4-hydroxy-5-methoxyphenyl)-1-cyclopentyl-4H-pyridine-3,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 4-(3-chloro-4-hydroxy-5-methoxyphenyl)-1-cyclopentyl-4H-pyridine-3,5-dicarboxylate Traditional Name: 4-(3-chloro-4-hydroxy-5-methoxy-phenyl)-1-cyclopentyl-4H-pyridine-3,5-dicarboxylic acid dimethyl ester Formula: C21H24ClNO6 MolecularWeight: 421.87136

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C2C(=CN(C=C2C(=O)OC)C3CCCC3)C(=O)OC)Cl)O

Isomeric SMILES

COC1=C(C(=CC(=C1)C2C(=CN(C=C2C(=O)OC)C3CCCC3)C(=O)OC)Cl)O

InChI

InChI=1S/C21H24ClNO6/c1-27-17-9-12(8-16(22)19(17)24)18-14(20(25)28-2)10-23(13-6-4-5-7-13)11-15(18)21(26)29-3/h8-11,13,18,24H,4-7H2,1-3H3