(1-oxidanylidene-4-phenyl-butan-2-yl) 4-methylbenzenesulfonate

Systemtic Name: (1-oxidanylidene-4-phenyl-butan-2-yl) 4-methylbenzenesulfonate Openeye Name: (1-formyl-3-phenyl-propyl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (1-oxo-4-phenylbutan-2-yl) ester IUPAC Name: (1-oxo-4-phenylbutan-2-yl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (1-formyl-3-phenyl-propyl) ester Formula: C17H18O4S MolecularWeight: 318.38742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC(CCC2=CC=CC=C2)C=O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC(CCC2=CC=CC=C2)C=O

InChI

InChI=1S/C17H18O4S/c1-14-7-11-17(12-8-14)22(19,20)21-16(13-18)10-9-15-5-3-2-4-6-15/h2-8,11-13,16H,9-10H2,1H3