[4-(4-oxidanylidenebutyl)phenyl] 4-methylbenzenesulfonate

Systemtic Name: [4-(4-oxidanylidenebutyl)phenyl] 4-methylbenzenesulfonate Openeye Name: [4-(4-oxobutyl)phenyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [4-(4-oxobutyl)phenyl] ester IUPAC Name: [4-(4-oxobutyl)phenyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [4-(4-ketobutyl)phenyl] ester Formula: C17H18O4S MolecularWeight: 318.38742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)CCCC=O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)CCCC=O

InChI

InChI=1S/C17H18O4S/c1-14-5-11-17(12-6-14)22(19,20)21-16-9-7-15(8-10-16)4-2-3-13-18/h5-13H,2-4H2,1H3