5-piperidin-1-ylsulfonyl-2-pyrrolidin-1-yl-benzoic acid

Systemtic Name: 5-piperidin-1-ylsulfonyl-2-pyrrolidin-1-yl-benzoic acid Openeye Name: 5-(1-piperidylsulfonyl)-2-pyrrolidin-1-yl-benzoic acid CAS Name: 5-(1-piperidinylsulfonyl)-2-(1-pyrrolidinyl)benzoic acid IUPAC Name: 5-piperidin-1-ylsulfonyl-2-pyrrolidin-1-ylbenzoic acid Traditional Name: 5-piperidinosulfonyl-2-pyrrolidino-benzoic acid Formula: C16H22N2O4S MolecularWeight: 338.42188

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)N3CCCC3)C(=O)O

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)N3CCCC3)C(=O)O

InChI

InChI=1S/C16H22N2O4S/c19-16(20)14-12-13(6-7-15(14)17-8-4-5-9-17)23(21,22)18-10-2-1-3-11-18/h6-7,12H,1-5,8-11H2,(H,19,20)