2-[5-butan-2-yl-2-(3-fluoranyl-4-methoxy-phenyl)-1H-indol-3-yl]ethanoic acid

Systemtic Name: 2-[5-butan-2-yl-2-(3-fluoranyl-4-methoxy-phenyl)-1H-indol-3-yl]ethanoic acid Openeye Name: 2-[2-(3-fluoro-4-methoxy-phenyl)-5-sec-butyl-1H-indol-3-yl]acetic acid CAS Name: 2-[5-butan-2-yl-2-(3-fluoro-4-methoxyphenyl)-1H-indol-3-yl]acetic acid IUPAC Name: 2-[5-butan-2-yl-2-(3-fluoro-4-methoxyphenyl)-1H-indol-3-yl]acetic acid Traditional Name: 2-[2-(3-fluoro-4-methoxy-phenyl)-5-sec-butyl-1H-indol-3-yl]acetic acid Formula: C21H22FNO3 MolecularWeight: 355.402683

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC2=C(C=C1)NC(=C2CC(=O)O)C3=CC(=C(C=C3)OC)F

Isomeric SMILES

CCC(C)C1=CC2=C(C=C1)NC(=C2CC(=O)O)C3=CC(=C(C=C3)OC)F

InChI

InChI=1S/C21H22FNO3/c1-4-12(2)13-5-7-18-15(9-13)16(11-20(24)25)21(23-18)14-6-8-19(26-3)17(22)10-14/h5-10,12,23H,4,11H2,1-3H3,(H,24,25)