3-methylbutyl 4-[(4-methylphenyl)sulfonylamino]benzoate

Systemtic Name: 3-methylbutyl 4-[(4-methylphenyl)sulfonylamino]benzoate Openeye Name: isopentyl 4-(p-tolylsulfonylamino)benzoate CAS Name: 4-[(4-methylphenyl)sulfonylamino]benzoic acid 3-methylbutyl ester IUPAC Name: 3-methylbutyl 4-[(4-methylphenyl)sulfonylamino]benzoate Traditional Name: 4-(tosylamino)benzoic acid isoamyl ester Formula: C19H23NO4S MolecularWeight: 361.45522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C(=O)OCCC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C(=O)OCCC(C)C

InChI

InChI=1S/C19H23NO4S/c1-14(2)12-13-24-19(21)16-6-8-17(9-7-16)20-25(22,23)18-10-4-15(3)5-11-18/h4-11,14,20H,12-13H2,1-3H3