4-[[ethyl-(3-methylphenyl)amino]methyl]benzenesulfonic acid

Systemtic Name: 4-[[ethyl-(3-methylphenyl)amino]methyl]benzenesulfonic acid Openeye Name: 4-[(N-ethyl-3-methyl-anilino)methyl]benzenesulfonic acid CAS Name: 4-[(N-ethyl-3-methylanilino)methyl]benzenesulfonic acid IUPAC Name: 4-[(N-ethyl-3-methylanilino)methyl]benzenesulfonic acid Traditional Name: 4-[(N-ethyl-3-methyl-anilino)methyl]besylic acid Formula: C16H19NO3S MolecularWeight: 305.39196

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=C(C=C1)S(=O)(=O)O)C2=CC=CC(=C2)C

Isomeric SMILES

CCN(CC1=CC=C(C=C1)S(=O)(=O)O)C2=CC=CC(=C2)C

InChI

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