1-phenylmethoxybutan-2-yl 4-methylbenzenesulfonate

Systemtic Name: 1-phenylmethoxybutan-2-yl 4-methylbenzenesulfonate Openeye Name: 1-(benzyloxymethyl)propyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 1-phenylmethoxybutan-2-yl ester IUPAC Name: 1-phenylmethoxybutan-2-yl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 1-(benzoxymethyl)propyl ester Formula: C18H22O4S MolecularWeight: 334.42988

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Descriptors Computed from Structure

Canonical SMILES:

CCC(COCC1=CC=CC=C1)OS(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCC(COCC1=CC=CC=C1)OS(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C18H22O4S/c1-3-17(14-21-13-16-7-5-4-6-8-16)22-23(19,20)18-11-9-15(2)10-12-18/h4-12,17H,3,13-14H2,1-2H3