dimethyl 5-[[1-(4-methylphenyl)sulfonylcyclopropyl]carbonylamino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[[1-(4-methylphenyl)sulfonylcyclopropyl]carbonylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[[1-(p-tolylsulfonyl)cyclopropanecarbonyl]amino]benzene-1,3-dicarboxylate CAS Name: 5-[[[1-(4-methylphenyl)sulfonylcyclopropyl]-oxomethyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[[1-(4-methylphenyl)sulfonylcyclopropanecarbonyl]amino]benzene-1,3-dicarboxylate Traditional Name: 5-[(1-tosylcyclopropanecarbonyl)amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C21H21NO7S MolecularWeight: 431.45894

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2(CC2)C(=O)NC3=CC(=CC(=C3)C(=O)OC)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2(CC2)C(=O)NC3=CC(=CC(=C3)C(=O)OC)C(=O)OC

InChI

InChI=1S/C21H21NO7S/c1-13-4-6-17(7-5-13)30(26,27)21(8-9-21)20(25)22-16-11-14(18(23)28-2)10-15(12-16)19(24)29-3/h4-7,10-12H,8-9H2,1-3H3,(H,22,25)