3-[2-(propan-2-yloxymethyl)pyrrolidin-1-yl]carbonylbenzoic acid

Systemtic Name: 3-[2-(propan-2-yloxymethyl)pyrrolidin-1-yl]carbonylbenzoic acid Openeye Name: 3-[2-(isopropoxymethyl)pyrrolidine-1-carbonyl]benzoic acid CAS Name: 3-[oxo-[2-(propan-2-yloxymethyl)-1-pyrrolidinyl]methyl]benzoic acid IUPAC Name: 3-[2-(propan-2-yloxymethyl)pyrrolidine-1-carbonyl]benzoic acid Traditional Name: 3-[2-(isopropoxymethyl)pyrrolidine-1-carbonyl]benzoic acid Formula: C16H21NO4 MolecularWeight: 291.34224

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCC1CCCN1C(=O)C2=CC(=CC=C2)C(=O)O

Isomeric SMILES

CC(C)OCC1CCCN1C(=O)C2=CC(=CC=C2)C(=O)O

InChI

InChI=1S/C16H21NO4/c1-11(2)21-10-14-7-4-8-17(14)15(18)12-5-3-6-13(9-12)16(19)20/h3,5-6,9,11,14H,4,7-8,10H2,1-2H3,(H,19,20)