(2-aminocarbonyl-5-methyl-phenyl) 4-tert-butylbenzenesulfonate

Systemtic Name: (2-aminocarbonyl-5-methyl-phenyl) 4-tert-butylbenzenesulfonate Openeye Name: (2-carbamoyl-5-methyl-phenyl) 4-tert-butylbenzenesulfonate CAS Name: 4-tert-butylbenzenesulfonic acid (2-carbamoyl-5-methylphenyl) ester IUPAC Name: (2-carbamoyl-5-methylphenyl) 4-tert-butylbenzenesulfonate Traditional Name: 4-tert-butylbenzenesulfonic acid (2-carbamoyl-5-methyl-phenyl) ester Formula: C18H21NO4S MolecularWeight: 347.42864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)N)OS(=O)(=O)C2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)N)OS(=O)(=O)C2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C18H21NO4S/c1-12-5-10-15(17(19)20)16(11-12)23-24(21,22)14-8-6-13(7-9-14)18(2,3)4/h5-11H,1-4H3,(H2,19,20)