3-phenyl-2-(propylamino)benzenesulfonic acid

Systemtic Name: 3-phenyl-2-(propylamino)benzenesulfonic acid Openeye Name: 3-phenyl-2-(propylamino)benzenesulfonic acid CAS Name: 3-phenyl-2-(propylamino)benzenesulfonic acid IUPAC Name: 3-phenyl-2-(propylamino)benzenesulfonic acid Traditional Name: 3-phenyl-2-(propylamino)besylic acid Formula: C15H17NO3S MolecularWeight: 291.36538

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=C(C=CC=C1S(=O)(=O)O)C2=CC=CC=C2

Isomeric SMILES

CCCNC1=C(C=CC=C1S(=O)(=O)O)C2=CC=CC=C2

InChI

InChI=1S/C15H17NO3S/c1-2-11-16-15-13(12-7-4-3-5-8-12)9-6-10-14(15)20(17,18)19/h3-10,16H,2,11H2,1H3,(H,17,18,19)