4-(dipropylsulfamoyl)benzoic acid; 1,3,5-trimethylbenzene

Systemtic Name: 4-(dipropylsulfamoyl)benzoic acid; 1,3,5-trimethylbenzene Openeye Name: 4-(dipropylsulfamoyl)benzoic acid; mesitylene CAS Name: 4-(dipropylsulfamoyl)benzoic acid; 1,3,5-trimethylbenzene IUPAC Name: 4-(dipropylsulfamoyl)benzoic acid; 1,3,5-trimethylbenzene Traditional Name: 4-(dipropylsulfamoyl)benzoic acid; mesitylene Formula: C22H31NO4S MolecularWeight: 405.55084

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)S(=O)(=O)C1=CC=C(C=C1)C(=O)O.CC1=CC(=CC(=C1)C)C

Isomeric SMILES

CCCN(CCC)S(=O)(=O)C1=CC=C(C=C1)C(=O)O.CC1=CC(=CC(=C1)C)C

InChI

InChI=1S/C13H19NO4S.C9H12/c1-3-9-14(10-4-2)19(17,18)12-7-5-11(6-8-12)13(15)16;1-7-4-8(2)6-9(3)5-7/h5-8H,3-4,9-10H2,1-2H3,(H,15,16);4-6H,1-3H3