4-[1-bromanyl-3-(phenylsulfonyl)propan-2-yl]oxybut-2-ynoxymethylbenzene

Systemtic Name: 4-[1-bromanyl-3-(phenylsulfonyl)propan-2-yl]oxybut-2-ynoxymethylbenzene Openeye Name: 4-[1-(benzenesulfonylmethyl)-2-bromo-ethoxy]but-2-ynoxymethylbenzene CAS Name: 4-[1-(benzenesulfonyl)-3-bromopropan-2-yl]oxybut-2-ynoxymethylbenzene IUPAC Name: 4-[1-(benzenesulfonyl)-3-bromopropan-2-yl]oxybut-2-ynoxymethylbenzene Traditional Name: 4-[1-(besylmethyl)-2-bromo-ethoxy]but-2-ynoxymethylbenzene Formula: C20H21BrO4S MolecularWeight: 437.34734

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COCC#CCOC(CS(=O)(=O)C2=CC=CC=C2)CBr

Isomeric SMILES

C1=CC=C(C=C1)COCC#CCOC(CS(=O)(=O)C2=CC=CC=C2)CBr

InChI

InChI=1S/C20H21BrO4S/c21-15-19(17-26(22,23)20-11-5-2-6-12-20)25-14-8-7-13-24-16-18-9-3-1-4-10-18/h1-6,9-12,19H,13-17H2