2-[1-[3-methoxy-5-(2-methyloctan-2-yl)phenyl]pyrrolidin-2-yl]ethanoic acid

Systemtic Name: 2-[1-[3-methoxy-5-(2-methyloctan-2-yl)phenyl]pyrrolidin-2-yl]ethanoic acid Openeye Name: 2-[1-[3-(1,1-dimethylheptyl)-5-methoxy-phenyl]pyrrolidin-2-yl]acetic acid CAS Name: 2-[1-[3-methoxy-5-(2-methyloctan-2-yl)phenyl]-2-pyrrolidinyl]acetic acid IUPAC Name: 2-[1-[3-methoxy-5-(2-methyloctan-2-yl)phenyl]pyrrolidin-2-yl]acetic acid Traditional Name: 2-[1-[3-(1,1-dimethylheptyl)-5-methoxy-phenyl]pyrrolidin-2-yl]acetic acid Formula: C22H35NO3 MolecularWeight: 361.5182

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)(C)C1=CC(=CC(=C1)OC)N2CCCC2CC(=O)O

Isomeric SMILES

CCCCCCC(C)(C)C1=CC(=CC(=C1)OC)N2CCCC2CC(=O)O

InChI

InChI=1S/C22H35NO3/c1-5-6-7-8-11-22(2,3)17-13-19(15-20(14-17)26-4)23-12-9-10-18(23)16-21(24)25/h13-15,18H,5-12,16H2,1-4H3,(H,24,25)