methyl 1-[[1-(5-chloranyl-2,4-dimethoxy-phenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylamino]cyclohexane-1-carboxylate

Systemtic Name: methyl 1-[[1-(5-chloranyl-2,4-dimethoxy-phenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylamino]cyclohexane-1-carboxylate Openeye Name: methyl 1-[[1-(5-chloro-2,4-dimethoxy-phenyl)-5-oxo-pyrrolidine-3-carbonyl]amino]cyclohexanecarboxylate CAS Name: 1-[[[1-(5-chloro-2,4-dimethoxyphenyl)-5-oxo-3-pyrrolidinyl]-oxomethyl]amino]-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 1-[[1-(5-chloro-2,4-dimethoxyphenyl)-5-oxopyrrolidine-3-carbonyl]amino]cyclohexane-1-carboxylate Traditional Name: 1-[[1-(5-chloro-2,4-dimethoxy-phenyl)-5-keto-pyrrolidine-3-carbonyl]amino]cyclohexanecarboxylic acid methyl ester Formula: C21H27ClN2O6 MolecularWeight: 438.90188

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1N2CC(CC2=O)C(=O)NC3(CCCCC3)C(=O)OC)Cl)OC

Isomeric SMILES

COC1=CC(=C(C=C1N2CC(CC2=O)C(=O)NC3(CCCCC3)C(=O)OC)Cl)OC

InChI

InChI=1S/C21H27ClN2O6/c1-28-16-11-17(29-2)15(10-14(16)22)24-12-13(9-18(24)25)19(26)23-21(20(27)30-3)7-5-4-6-8-21/h10-11,13H,4-9,12H2,1-3H3,(H,23,26)