[4-(tert-butylcarbamoyl)phenyl] 2,5-dimethylbenzenesulfonate

Systemtic Name: [4-(tert-butylcarbamoyl)phenyl] 2,5-dimethylbenzenesulfonate Openeye Name: [4-(tert-butylcarbamoyl)phenyl] 2,5-dimethylbenzenesulfonate CAS Name: 2,5-dimethylbenzenesulfonic acid [4-[(tert-butylamino)-oxomethyl]phenyl] ester IUPAC Name: [4-(tert-butylcarbamoyl)phenyl] 2,5-dimethylbenzenesulfonate Traditional Name: 2,5-dimethylbenzenesulfonic acid [4-(tert-butylcarbamoyl)phenyl] ester Formula: C19H23NO4S MolecularWeight: 361.45522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)OC2=CC=C(C=C2)C(=O)NC(C)(C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)OC2=CC=C(C=C2)C(=O)NC(C)(C)C

InChI

InChI=1S/C19H23NO4S/c1-13-6-7-14(2)17(12-13)25(22,23)24-16-10-8-15(9-11-16)18(21)20-19(3,4)5/h6-12H,1-5H3,(H,20,21)