2-[(2-chlorophenyl)methyl]-4-methyl-benzenesulfonic acid

Systemtic Name: 2-[(2-chlorophenyl)methyl]-4-methyl-benzenesulfonic acid Openeye Name: 2-[(2-chlorophenyl)methyl]-4-methyl-benzenesulfonic acid CAS Name: 2-[(2-chlorophenyl)methyl]-4-methylbenzenesulfonic acid IUPAC Name: 2-[(2-chlorophenyl)methyl]-4-methylbenzenesulfonic acid Traditional Name: 2-(2-chlorobenzyl)-4-methyl-besylic acid Formula: C14H13ClO3S MolecularWeight: 296.76922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)O)CC2=CC=CC=C2Cl

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)O)CC2=CC=CC=C2Cl

InChI

InChI=1S/C14H13ClO3S/c1-10-6-7-14(19(16,17)18)12(8-10)9-11-4-2-3-5-13(11)15/h2-8H,9H2,1H3,(H,16,17,18)