[2-methoxy-4-[(E)-prop-1-enyl]phenyl] 4-methylbenzenesulfonate

Systemtic Name: [2-methoxy-4-[(E)-prop-1-enyl]phenyl] 4-methylbenzenesulfonate Openeye Name: [2-methoxy-4-[(E)-prop-1-enyl]phenyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [2-methoxy-4-[(E)-prop-1-enyl]phenyl] ester IUPAC Name: [2-methoxy-4-[(E)-prop-1-enyl]phenyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [2-methoxy-4-[(E)-prop-1-enyl]phenyl] ester Formula: C17H18O4S MolecularWeight: 318.38742

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC=CC1=CC(=C(C=C1)OS(=O)(=O)C2=CC=C(C=C2)C)OC

Isomeric SMILES

C/C=C/C1=CC(=C(C=C1)OS(=O)(=O)C2=CC=C(C=C2)C)OC

InChI

InChI=1S/C17H18O4S/c1-4-5-14-8-11-16(17(12-14)20-3)21-22(18,19)15-9-6-13(2)7-10-15/h4-12H,1-3H3/b5-4+