2-(dimethylamino)-4-methyl-6-(phenylmethyl)benzenesulfonic acid

Systemtic Name: 2-(dimethylamino)-4-methyl-6-(phenylmethyl)benzenesulfonic acid Openeye Name: 2-benzyl-6-(dimethylamino)-4-methyl-benzenesulfonic acid CAS Name: 2-(dimethylamino)-4-methyl-6-(phenylmethyl)benzenesulfonic acid IUPAC Name: 2-benzyl-6-(dimethylamino)-4-methylbenzenesulfonic acid Traditional Name: 2-benzyl-6-(dimethylamino)-4-methyl-besylic acid Formula: C16H19NO3S MolecularWeight: 305.39196

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)N(C)C)S(=O)(=O)O)CC2=CC=CC=C2

Isomeric SMILES

CC1=CC(=C(C(=C1)N(C)C)S(=O)(=O)O)CC2=CC=CC=C2

InChI

InChI=1S/C16H19NO3S/c1-12-9-14(11-13-7-5-4-6-8-13)16(21(18,19)20)15(10-12)17(2)3/h4-10H,11H2,1-3H3,(H,18,19,20)