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

Systemtic Name: 3-[[4-[1-(2-ethoxyethyl)-6-fluoranyl-indol-3-yl]piperidin-1-yl]methyl]-2-methoxy-benzoic acid Openeye Name: 3-[[4-[1-(2-ethoxyethyl)-6-fluoro-indol-3-yl]-1-piperidyl]methyl]-2-methoxy-benzoic acid CAS Name: 3-[[4-[1-(2-ethoxyethyl)-6-fluoro-3-indolyl]-1-piperidinyl]methyl]-2-methoxybenzoic acid IUPAC Name: 3-[[4-[1-(2-ethoxyethyl)-6-fluoroindol-3-yl]piperidin-1-yl]methyl]-2-methoxybenzoic acid Traditional Name: 3-[[4-[1-(2-ethoxyethyl)-6-fluoro-indol-3-yl]piperidino]methyl]-2-methoxy-benzoic acid Formula: C26H31FN2O4 MolecularWeight: 454.533743

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCN1C=C(C2=C1C=C(C=C2)F)C3CCN(CC3)CC4=CC=CC(=C4OC)C(=O)O

Isomeric SMILES

CCOCCN1C=C(C2=C1C=C(C=C2)F)C3CCN(CC3)CC4=CC=CC(=C4OC)C(=O)O

InChI

InChI=1S/C26H31FN2O4/c1-3-33-14-13-29-17-23(21-8-7-20(27)15-24(21)29)18-9-11-28(12-10-18)16-19-5-4-6-22(26(30)31)25(19)32-2/h4-8,15,17-18H,3,9-14,16H2,1-2H3,(H,30,31)