3-[1-(4-tert-butylphenyl)pyrrolidin-3-yl]-2-methoxy-benzoic acid

Systemtic Name: 3-[1-(4-tert-butylphenyl)pyrrolidin-3-yl]-2-methoxy-benzoic acid Openeye Name: 3-[1-(4-tert-butylphenyl)pyrrolidin-3-yl]-2-methoxy-benzoic acid CAS Name: 3-[1-(4-tert-butylphenyl)-3-pyrrolidinyl]-2-methoxybenzoic acid IUPAC Name: 3-[1-(4-tert-butylphenyl)pyrrolidin-3-yl]-2-methoxybenzoic acid Traditional Name: 3-[1-(4-tert-butylphenyl)pyrrolidin-3-yl]-2-methoxy-benzoic acid Formula: C22H27NO3 MolecularWeight: 353.45468

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)N2CCC(C2)C3=CC=CC(=C3OC)C(=O)O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)N2CCC(C2)C3=CC=CC(=C3OC)C(=O)O

InChI

InChI=1S/C22H27NO3/c1-22(2,3)16-8-10-17(11-9-16)23-13-12-15(14-23)18-6-5-7-19(21(24)25)20(18)26-4/h5-11,15H,12-14H2,1-4H3,(H,24,25)