4-methyl-3-[(2,4,6-trimethylphenyl)methyl]benzenesulfonic acid

Systemtic Name: 4-methyl-3-[(2,4,6-trimethylphenyl)methyl]benzenesulfonic acid Openeye Name: 4-methyl-3-[(2,4,6-trimethylphenyl)methyl]benzenesulfonic acid CAS Name: 4-methyl-3-[(2,4,6-trimethylphenyl)methyl]benzenesulfonic acid IUPAC Name: 4-methyl-3-[(2,4,6-trimethylphenyl)methyl]benzenesulfonic acid Traditional Name: 4-methyl-3-(2,4,6-trimethylbenzyl)besylic acid Formula: C17H20O3S MolecularWeight: 304.4039

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)O)CC2=C(C=C(C=C2C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)O)CC2=C(C=C(C=C2C)C)C

InChI

InChI=1S/C17H20O3S/c1-11-7-13(3)17(14(4)8-11)10-15-9-16(21(18,19)20)6-5-12(15)2/h5-9H,10H2,1-4H3,(H,18,19,20)