4-methyl-2,3-bis(phenylmethyl)benzenesulfonic acid

Systemtic Name: 4-methyl-2,3-bis(phenylmethyl)benzenesulfonic acid Openeye Name: 2,3-dibenzyl-4-methyl-benzenesulfonic acid CAS Name: 4-methyl-2,3-bis(phenylmethyl)benzenesulfonic acid IUPAC Name: 2,3-dibenzyl-4-methylbenzenesulfonic acid Traditional Name: 2,3-dibenzyl-4-methyl-besylic acid Formula: C21H20O3S MolecularWeight: 352.4467

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)S(=O)(=O)O)CC2=CC=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=C(C=C1)S(=O)(=O)O)CC2=CC=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C21H20O3S/c1-16-12-13-21(25(22,23)24)20(15-18-10-6-3-7-11-18)19(16)14-17-8-4-2-5-9-17/h2-13H,14-15H2,1H3,(H,22,23,24)