3-ethylbenzenesulfonic acid; 3-methylaniline

Systemtic Name: 3-ethylbenzenesulfonic acid; 3-methylaniline Openeye Name: 3-ethylbenzenesulfonic acid; 3-methylaniline CAS Name: 3-ethylbenzenesulfonic acid; 3-methylaniline IUPAC Name: 3-ethylbenzenesulfonic acid; 3-methylaniline Traditional Name: 3-ethylbesylic acid; m-toluidine Formula: C15H19NO3S MolecularWeight: 293.38126

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)S(=O)(=O)O.CC1=CC(=CC=C1)N

Isomeric SMILES

CCC1=CC(=CC=C1)S(=O)(=O)O.CC1=CC(=CC=C1)N

InChI

InChI=1S/C8H10O3S.C7H9N/c1-2-7-4-3-5-8(6-7)12(9,10)11;1-6-3-2-4-7(8)5-6/h3-6H,2H2,1H3,(H,9,10,11);2-5H,8H2,1H3