1-[furan-2-yl-(4-propan-2-ylphenyl)methyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[furan-2-yl-(4-propan-2-ylphenyl)methyl]piperidine-4-carboxylic acid Openeye Name: 1-[2-furyl-(4-isopropylphenyl)methyl]piperidine-4-carboxylic acid CAS Name: 1-[2-furanyl-(4-propan-2-ylphenyl)methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[furan-2-yl-(4-propan-2-ylphenyl)methyl]piperidine-4-carboxylic acid Traditional Name: 1-[2-furyl(p-cumenyl)methyl]isonipecotic acid Formula: C20H25NO3 MolecularWeight: 327.4174

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(C2=CC=CO2)N3CCC(CC3)C(=O)O

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C(C2=CC=CO2)N3CCC(CC3)C(=O)O

InChI

InChI=1S/C20H25NO3/c1-14(2)15-5-7-16(8-6-15)19(18-4-3-13-24-18)21-11-9-17(10-12-21)20(22)23/h3-8,13-14,17,19H,9-12H2,1-2H3,(H,22,23)