2-[2-[ethyl-(3-methylphenyl)amino]ethyl]benzenesulfonic acid

Systemtic Name: 2-[2-[ethyl-(3-methylphenyl)amino]ethyl]benzenesulfonic acid Openeye Name: 2-[2-(N-ethyl-3-methyl-anilino)ethyl]benzenesulfonic acid CAS Name: 2-[2-(N-ethyl-3-methylanilino)ethyl]benzenesulfonic acid IUPAC Name: 2-[2-(N-ethyl-3-methylanilino)ethyl]benzenesulfonic acid Traditional Name: 2-[2-(N-ethyl-3-methyl-anilino)ethyl]besylic acid Formula: C17H21NO3S MolecularWeight: 319.41854

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCC1=CC=CC=C1S(=O)(=O)O)C2=CC=CC(=C2)C

Isomeric SMILES

CCN(CCC1=CC=CC=C1S(=O)(=O)O)C2=CC=CC(=C2)C

InChI

InChI=1S/C17H21NO3S/c1-3-18(16-9-6-7-14(2)13-16)12-11-15-8-4-5-10-17(15)22(19,20)21/h4-10,13H,3,11-12H2,1-2H3,(H,19,20,21)