4-(4-pyrrolidin-1-ylphenyl)benzenesulfonic acid

Systemtic Name: 4-(4-pyrrolidin-1-ylphenyl)benzenesulfonic acid Openeye Name: 4-(4-pyrrolidin-1-ylphenyl)benzenesulfonic acid CAS Name: 4-[4-(1-pyrrolidinyl)phenyl]benzenesulfonic acid IUPAC Name: 4-(4-pyrrolidin-1-ylphenyl)benzenesulfonic acid Traditional Name: 4-(4-pyrrolidinophenyl)besylic acid Formula: C16H17NO3S MolecularWeight: 303.37608

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17NO3S/c18-21(19,20)16-9-5-14(6-10-16)13-3-7-15(8-4-13)17-11-1-2-12-17/h3-10H,1-2,11-12H2,(H,18,19,20)