2-[[4-[7-bromanyl-1-(2-ethoxyethyl)indol-3-yl]piperidin-1-yl]methyl]-3-fluoranyl-benzoic acid

Systemtic Name: 2-[[4-[7-bromanyl-1-(2-ethoxyethyl)indol-3-yl]piperidin-1-yl]methyl]-3-fluoranyl-benzoic acid Openeye Name: 2-[[4-[7-bromo-1-(2-ethoxyethyl)indol-3-yl]-1-piperidyl]methyl]-3-fluoro-benzoic acid CAS Name: 2-[[4-[7-bromo-1-(2-ethoxyethyl)-3-indolyl]-1-piperidinyl]methyl]-3-fluorobenzoic acid IUPAC Name: 2-[[4-[7-bromo-1-(2-ethoxyethyl)indol-3-yl]piperidin-1-yl]methyl]-3-fluorobenzoic acid Traditional Name: 2-[[4-[7-bromo-1-(2-ethoxyethyl)indol-3-yl]piperidino]methyl]-3-fluoro-benzoic acid Formula: C25H28BrFN2O3 MolecularWeight: 503.403823

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCN1C=C(C2=C1C(=CC=C2)Br)C3CCN(CC3)CC4=C(C=CC=C4F)C(=O)O

Isomeric SMILES

CCOCCN1C=C(C2=C1C(=CC=C2)Br)C3CCN(CC3)CC4=C(C=CC=C4F)C(=O)O

InChI

InChI=1S/C25H28BrFN2O3/c1-2-32-14-13-29-16-20(18-5-3-7-22(26)24(18)29)17-9-11-28(12-10-17)15-21-19(25(30)31)6-4-8-23(21)27/h3-8,16-17H,2,9-15H2,1H3,(H,30,31)