3-butyl-2-[ethyl(phenyl)amino]benzenesulfonic acid

Systemtic Name: 3-butyl-2-[ethyl(phenyl)amino]benzenesulfonic acid Openeye Name: 3-butyl-2-(N-ethylanilino)benzenesulfonic acid CAS Name: 3-butyl-2-(N-ethylanilino)benzenesulfonic acid IUPAC Name: 3-butyl-2-(N-ethylanilino)benzenesulfonic acid Traditional Name: 3-butyl-2-(N-ethylanilino)besylic acid Formula: C18H23NO3S MolecularWeight: 333.44512

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=CC=C1)S(=O)(=O)O)N(CC)C2=CC=CC=C2

Isomeric SMILES

CCCCC1=C(C(=CC=C1)S(=O)(=O)O)N(CC)C2=CC=CC=C2

InChI

InChI=1S/C18H23NO3S/c1-3-5-10-15-11-9-14-17(23(20,21)22)18(15)19(4-2)16-12-7-6-8-13-16/h6-9,11-14H,3-5,10H2,1-2H3,(H,20,21,22)