[1-(2-bromophenyl)sulfonyl-4-methyl-pent-3-en-2-yl] benzoate

Systemtic Name: [1-(2-bromophenyl)sulfonyl-4-methyl-pent-3-en-2-yl] benzoate Openeye Name: [1-[(2-bromophenyl)sulfonylmethyl]-3-methyl-but-2-enyl] benzoate CAS Name: benzoic acid [1-(2-bromophenyl)sulfonyl-4-methylpent-3-en-2-yl] ester IUPAC Name: [1-(2-bromophenyl)sulfonyl-4-methylpent-3-en-2-yl] benzoate Traditional Name: benzoic acid [1-[(2-bromophenyl)sulfonylmethyl]-3-methyl-but-2-enyl] ester Formula: C19H19BrO4S MolecularWeight: 423.32076

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(CS(=O)(=O)C1=CC=CC=C1Br)OC(=O)C2=CC=CC=C2)C

Isomeric SMILES

CC(=CC(CS(=O)(=O)C1=CC=CC=C1Br)OC(=O)C2=CC=CC=C2)C

InChI

InChI=1S/C19H19BrO4S/c1-14(2)12-16(24-19(21)15-8-4-3-5-9-15)13-25(22,23)18-11-7-6-10-17(18)20/h3-12,16H,13H2,1-2H3