3-(1-phenyl-3-pyrrolidin-1-yl-propyl)benzenesulfonic acid

Systemtic Name: 3-(1-phenyl-3-pyrrolidin-1-yl-propyl)benzenesulfonic acid Openeye Name: 3-(1-phenyl-3-pyrrolidin-1-yl-propyl)benzenesulfonic acid CAS Name: 3-[1-phenyl-3-(1-pyrrolidinyl)propyl]benzenesulfonic acid IUPAC Name: 3-(1-phenyl-3-pyrrolidin-1-ylpropyl)benzenesulfonic acid Traditional Name: 3-(1-phenyl-3-pyrrolidino-propyl)besylic acid Formula: C19H23NO3S MolecularWeight: 345.45582

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCC(C2=CC=CC=C2)C3=CC(=CC=C3)S(=O)(=O)O

Isomeric SMILES

C1CCN(C1)CCC(C2=CC=CC=C2)C3=CC(=CC=C3)S(=O)(=O)O

InChI

InChI=1S/C19H23NO3S/c21-24(22,23)18-10-6-9-17(15-18)19(16-7-2-1-3-8-16)11-14-20-12-4-5-13-20/h1-3,6-10,15,19H,4-5,11-14H2,(H,21,22,23)