methyl 3-[[1-(4-chlorophenyl)sulfonylcyclopentyl]carbonylamino]-4-methyl-benzoate

Systemtic Name: methyl 3-[[1-(4-chlorophenyl)sulfonylcyclopentyl]carbonylamino]-4-methyl-benzoate Openeye Name: methyl 3-[[1-(4-chlorophenyl)sulfonylcyclopentanecarbonyl]amino]-4-methyl-benzoate CAS Name: 3-[[[1-(4-chlorophenyl)sulfonylcyclopentyl]-oxomethyl]amino]-4-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[[1-(4-chlorophenyl)sulfonylcyclopentanecarbonyl]amino]-4-methylbenzoate Traditional Name: 3-[[1-(4-chlorophenyl)sulfonylcyclopentanecarbonyl]amino]-4-methyl-benzoic acid methyl ester Formula: C21H22ClNO5S MolecularWeight: 435.92108

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22ClNO5S/c1-14-5-6-15(19(24)28-2)13-18(14)23-20(25)21(11-3-4-12-21)29(26,27)17-9-7-16(22)8-10-17/h5-10,13H,3-4,11-12H2,1-2H3,(H,23,25)