2-[5-(phenylmethyl)thiophen-2-yl]oxyethyl 4-methylbenzenesulfonate

Systemtic Name: 2-[5-(phenylmethyl)thiophen-2-yl]oxyethyl 4-methylbenzenesulfonate Openeye Name: 2-[(5-benzyl-2-thienyl)oxy]ethyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 2-[[5-(phenylmethyl)-2-thiophenyl]oxy]ethyl ester IUPAC Name: 2-(5-benzylthiophen-2-yl)oxyethyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 2-[(5-benzyl-2-thienyl)oxy]ethyl ester Formula: C20H20O4S2 MolecularWeight: 388.5004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCOC2=CC=C(S2)CC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCOC2=CC=C(S2)CC3=CC=CC=C3

InChI

InChI=1S/C20H20O4S2/c1-16-7-10-19(11-8-16)26(21,22)24-14-13-23-20-12-9-18(25-20)15-17-5-3-2-4-6-17/h2-12H,13-15H2,1H3