methyl 3-[[1-(2,5-dimethylphenyl)sulfonylcyclopentyl]carbonylamino]benzoate

Systemtic Name: methyl 3-[[1-(2,5-dimethylphenyl)sulfonylcyclopentyl]carbonylamino]benzoate Openeye Name: methyl 3-[[1-(2,5-dimethylphenyl)sulfonylcyclopentanecarbonyl]amino]benzoate CAS Name: 3-[[[1-(2,5-dimethylphenyl)sulfonylcyclopentyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[[1-(2,5-dimethylphenyl)sulfonylcyclopentanecarbonyl]amino]benzoate Traditional Name: 3-[[1-(2,5-dimethylphenyl)sulfonylcyclopentanecarbonyl]amino]benzoic acid methyl ester Formula: C22H25NO5S MolecularWeight: 415.5026

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)C2(CCCC2)C(=O)NC3=CC=CC(=C3)C(=O)OC

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)C2(CCCC2)C(=O)NC3=CC=CC(=C3)C(=O)OC

InChI

InChI=1S/C22H25NO5S/c1-15-9-10-16(2)19(13-15)29(26,27)22(11-4-5-12-22)21(25)23-18-8-6-7-17(14-18)20(24)28-3/h6-10,13-14H,4-5,11-12H2,1-3H3,(H,23,25)