3,5-dimethyl-4-(2-pyrrolidin-1-ylethoxy)benzoic acid

Systemtic Name: 3,5-dimethyl-4-(2-pyrrolidin-1-ylethoxy)benzoic acid Openeye Name: 3,5-dimethyl-4-(2-pyrrolidin-1-ylethoxy)benzoic acid CAS Name: 3,5-dimethyl-4-[2-(1-pyrrolidinyl)ethoxy]benzoic acid IUPAC Name: 3,5-dimethyl-4-(2-pyrrolidin-1-ylethoxy)benzoic acid Traditional Name: 3,5-dimethyl-4-(2-pyrrolidinoethoxy)benzoic acid Formula: C15H21NO3 MolecularWeight: 263.33214

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCCN2CCCC2)C)C(=O)O

Isomeric SMILES

CC1=CC(=CC(=C1OCCN2CCCC2)C)C(=O)O

InChI

InChI=1S/C15H21NO3/c1-11-9-13(15(17)18)10-12(2)14(11)19-8-7-16-5-3-4-6-16/h9-10H,3-8H2,1-2H3,(H,17,18)