methyl 4-[[[1-(4-chlorophenyl)sulfonylcyclopentyl]carbonyl-methyl-amino]methyl]benzoate

Systemtic Name: methyl 4-[[[1-(4-chlorophenyl)sulfonylcyclopentyl]carbonyl-methyl-amino]methyl]benzoate Openeye Name: methyl 4-[[[1-(4-chlorophenyl)sulfonylcyclopentanecarbonyl]-methyl-amino]methyl]benzoate CAS Name: 4-[[[[1-(4-chlorophenyl)sulfonylcyclopentyl]-oxomethyl]-methylamino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[1-(4-chlorophenyl)sulfonylcyclopentanecarbonyl]-methylamino]methyl]benzoate Traditional Name: 4-[[[1-(4-chlorophenyl)sulfonylcyclopentanecarbonyl]-methyl-amino]methyl]benzoic acid methyl ester Formula: C22H24ClNO5S MolecularWeight: 449.94766

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24ClNO5S/c1-24(15-16-5-7-17(8-6-16)20(25)29-2)21(26)22(13-3-4-14-22)30(27,28)19-11-9-18(23)10-12-19/h5-12H,3-4,13-15H2,1-2H3