(2-aminocarbonylphenyl) 5-tert-butyl-2-methyl-benzenesulfonate

Systemtic Name: (2-aminocarbonylphenyl) 5-tert-butyl-2-methyl-benzenesulfonate Openeye Name: (2-carbamoylphenyl) 5-tert-butyl-2-methyl-benzenesulfonate CAS Name: 5-tert-butyl-2-methylbenzenesulfonic acid (2-carbamoylphenyl) ester IUPAC Name: (2-carbamoylphenyl) 5-tert-butyl-2-methylbenzenesulfonate Traditional Name: 5-tert-butyl-2-methyl-benzenesulfonic acid (2-carbamoylphenyl) ester Formula: C18H21NO4S MolecularWeight: 347.42864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(C)(C)C)S(=O)(=O)OC2=CC=CC=C2C(=O)N

Isomeric SMILES

CC1=C(C=C(C=C1)C(C)(C)C)S(=O)(=O)OC2=CC=CC=C2C(=O)N

InChI

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