3-[(2-bromophenyl)methoxy]propyl 4-methylbenzenesulfonate

Systemtic Name: 3-[(2-bromophenyl)methoxy]propyl 4-methylbenzenesulfonate Openeye Name: 3-[(2-bromophenyl)methoxy]propyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 3-[(2-bromophenyl)methoxy]propyl ester IUPAC Name: 3-[(2-bromophenyl)methoxy]propyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 3-(2-bromobenzyl)oxypropyl ester Formula: C17H19BrO4S MolecularWeight: 399.29936

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCCOCC2=CC=CC=C2Br

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCCOCC2=CC=CC=C2Br

InChI

InChI=1S/C17H19BrO4S/c1-14-7-9-16(10-8-14)23(19,20)22-12-4-11-21-13-15-5-2-3-6-17(15)18/h2-3,5-10H,4,11-13H2,1H3