5-[[4-[1-(2-ethoxyethyl)indol-3-yl]piperidin-1-yl]methyl]-2-fluoranyl-benzoic acid

Systemtic Name: 5-[[4-[1-(2-ethoxyethyl)indol-3-yl]piperidin-1-yl]methyl]-2-fluoranyl-benzoic acid Openeye Name: 5-[[4-[1-(2-ethoxyethyl)indol-3-yl]-1-piperidyl]methyl]-2-fluoro-benzoic acid CAS Name: 5-[[4-[1-(2-ethoxyethyl)-3-indolyl]-1-piperidinyl]methyl]-2-fluorobenzoic acid IUPAC Name: 5-[[4-[1-(2-ethoxyethyl)indol-3-yl]piperidin-1-yl]methyl]-2-fluorobenzoic acid Traditional Name: 5-[[4-[1-(2-ethoxyethyl)indol-3-yl]piperidino]methyl]-2-fluoro-benzoic acid Formula: C25H29FN2O3 MolecularWeight: 424.507763

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCN1C=C(C2=CC=CC=C21)C3CCN(CC3)CC4=CC(=C(C=C4)F)C(=O)O

Isomeric SMILES

CCOCCN1C=C(C2=CC=CC=C21)C3CCN(CC3)CC4=CC(=C(C=C4)F)C(=O)O

InChI

InChI=1S/C25H29FN2O3/c1-2-31-14-13-28-17-22(20-5-3-4-6-24(20)28)19-9-11-27(12-10-19)16-18-7-8-23(26)21(15-18)25(29)30/h3-8,15,17,19H,2,9-14,16H2,1H3,(H,29,30)