2-[4-(thiophen-3-ylmethyl)phenoxy]ethyl 4-methylbenzenesulfonate

Systemtic Name: 2-[4-(thiophen-3-ylmethyl)phenoxy]ethyl 4-methylbenzenesulfonate Openeye Name: 2-[4-(3-thienylmethyl)phenoxy]ethyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 2-[4-(3-thiophenylmethyl)phenoxy]ethyl ester IUPAC Name: 2-[4-(thiophen-3-ylmethyl)phenoxy]ethyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 2-[4-(3-thenyl)phenoxy]ethyl ester Formula: C20H20O4S2 MolecularWeight: 388.5004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCOC2=CC=C(C=C2)CC3=CSC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCOC2=CC=C(C=C2)CC3=CSC=C3

InChI

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