3-[[phenyl(propyl)amino]methyl]benzenesulfonic acid

Systemtic Name: 3-[[phenyl(propyl)amino]methyl]benzenesulfonic acid Openeye Name: 3-[(N-propylanilino)methyl]benzenesulfonic acid CAS Name: 3-[(N-propylanilino)methyl]benzenesulfonic acid IUPAC Name: 3-[(N-propylanilino)methyl]benzenesulfonic acid Traditional Name: 3-[(N-propylanilino)methyl]besylic acid Formula: C16H19NO3S MolecularWeight: 305.39196

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1=CC(=CC=C1)S(=O)(=O)O)C2=CC=CC=C2

Isomeric SMILES

CCCN(CC1=CC(=CC=C1)S(=O)(=O)O)C2=CC=CC=C2

InChI

InChI=1S/C16H19NO3S/c1-2-11-17(15-8-4-3-5-9-15)13-14-7-6-10-16(12-14)21(18,19)20/h3-10,12H,2,11,13H2,1H3,(H,18,19,20)