(1-oxidanylidene-5-phenyl-pentan-2-yl) 4-methylbenzenesulfonate

Systemtic Name: (1-oxidanylidene-5-phenyl-pentan-2-yl) 4-methylbenzenesulfonate Openeye Name: (1-formyl-4-phenyl-butyl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (1-oxo-5-phenylpentan-2-yl) ester IUPAC Name: (1-oxo-5-phenylpentan-2-yl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (1-formyl-4-phenyl-butyl) ester Formula: C18H20O4S MolecularWeight: 332.414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC(CCCC2=CC=CC=C2)C=O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC(CCCC2=CC=CC=C2)C=O

InChI

InChI=1S/C18H20O4S/c1-15-10-12-18(13-11-15)23(20,21)22-17(14-19)9-5-8-16-6-3-2-4-7-16/h2-4,6-7,10-14,17H,5,8-9H2,1H3