3-[[4-[6-fluoranyl-1-(furan-2-ylmethyl)indol-3-yl]piperidin-1-yl]methyl]benzoic acid

Systemtic Name: 3-[[4-[6-fluoranyl-1-(furan-2-ylmethyl)indol-3-yl]piperidin-1-yl]methyl]benzoic acid Openeye Name: 3-[[4-[6-fluoro-1-(2-furylmethyl)indol-3-yl]-1-piperidyl]methyl]benzoic acid CAS Name: 3-[[4-[6-fluoro-1-(2-furanylmethyl)-3-indolyl]-1-piperidinyl]methyl]benzoic acid IUPAC Name: 3-[[4-[6-fluoro-1-(furan-2-ylmethyl)indol-3-yl]piperidin-1-yl]methyl]benzoic acid Traditional Name: 3-[[4-[6-fluoro-1-(2-furfuryl)indol-3-yl]piperidino]methyl]benzoic acid Formula: C26H25FN2O3 MolecularWeight: 432.486703

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=CN(C3=C2C=CC(=C3)F)CC4=CC=CO4)CC5=CC=CC(=C5)C(=O)O

Isomeric SMILES

C1CN(CCC1C2=CN(C3=C2C=CC(=C3)F)CC4=CC=CO4)CC5=CC=CC(=C5)C(=O)O

InChI

InChI=1S/C26H25FN2O3/c27-21-6-7-23-24(17-29(25(23)14-21)16-22-5-2-12-32-22)19-8-10-28(11-9-19)15-18-3-1-4-20(13-18)26(30)31/h1-7,12-14,17,19H,8-11,15-16H2,(H,30,31)