2-[2-(1-oxidanylpyrrolidin-3-yl)phenyl]carbonylbenzoic acid

Systemtic Name: 2-[2-(1-oxidanylpyrrolidin-3-yl)phenyl]carbonylbenzoic acid Openeye Name: 2-[2-(1-hydroxypyrrolidin-3-yl)benzoyl]benzoic acid CAS Name: 2-[[2-(1-hydroxy-3-pyrrolidinyl)phenyl]-oxomethyl]benzoic acid IUPAC Name: 2-[2-(1-hydroxypyrrolidin-3-yl)benzoyl]benzoic acid Traditional Name: 2-[2-(1-hydroxypyrrolidin-3-yl)benzoyl]benzoic acid Formula: C18H17NO4 MolecularWeight: 311.33188

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1C2=CC=CC=C2C(=O)C3=CC=CC=C3C(=O)O)O

Isomeric SMILES

C1CN(CC1C2=CC=CC=C2C(=O)C3=CC=CC=C3C(=O)O)O

InChI

InChI=1S/C18H17NO4/c20-17(15-7-3-4-8-16(15)18(21)22)14-6-2-1-5-13(14)12-9-10-19(23)11-12/h1-8,12,23H,9-11H2,(H,21,22)