1-[(4-ethylphenyl)-(furan-2-yl)methyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[(4-ethylphenyl)-(furan-2-yl)methyl]piperidine-3-carboxylic acid Openeye Name: 1-[(4-ethylphenyl)-(2-furyl)methyl]piperidine-3-carboxylic acid CAS Name: 1-[(4-ethylphenyl)-(2-furanyl)methyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[(4-ethylphenyl)-(furan-2-yl)methyl]piperidine-3-carboxylic acid Traditional Name: 1-[(4-ethylphenyl)-(2-furyl)methyl]nipecotic acid Formula: C19H23NO3 MolecularWeight: 313.39082

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C2=CC=CO2)N3CCCC(C3)C(=O)O

Isomeric SMILES

CCC1=CC=C(C=C1)C(C2=CC=CO2)N3CCCC(C3)C(=O)O

InChI

InChI=1S/C19H23NO3/c1-2-14-7-9-15(10-8-14)18(17-6-4-12-23-17)20-11-3-5-16(13-20)19(21)22/h4,6-10,12,16,18H,2-3,5,11,13H2,1H3,(H,21,22)