4-methylbenzenesulfonic acid; prop-2-enoate

Systemtic Name: 4-methylbenzenesulfonic acid; prop-2-enoate Openeye Name: 4-methylbenzenesulfonic acid; prop-2-enoate CAS Name: 4-methylbenzenesulfonic acid; 2-propenoate IUPAC Name: 4-methylbenzenesulfonic acid; prop-2-enoate Traditional Name: acrylate; tosylic acid Formula: C10H11O5S- MolecularWeight: 243.25634

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)O.C=CC(=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O.C=CC(=O)[O-]

InChI

InChI=1S/C7H8O3S.C3H4O2/c1-6-2-4-7(5-3-6)11(8,9)10;1-2-3(4)5/h2-5H,1H3,(H,8,9,10);2H,1H2,(H,4,5)/p-1