4-[[2-(6-fluoranylindol-1-yl)ethanoylamino]methyl]benzoic acid

Systemtic Name: 4-[[2-(6-fluoranylindol-1-yl)ethanoylamino]methyl]benzoic acid Openeye Name: 4-[[[2-(6-fluoroindol-1-yl)acetyl]amino]methyl]benzoic acid CAS Name: 4-[[[2-(6-fluoro-1-indolyl)-1-oxoethyl]amino]methyl]benzoic acid IUPAC Name: 4-[[[2-(6-fluoroindol-1-yl)acetyl]amino]methyl]benzoic acid Traditional Name: 4-[[[2-(6-fluoroindol-1-yl)acetyl]amino]methyl]benzoic acid Formula: C18H15FN2O3 MolecularWeight: 326.321703

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC2=C1C=CN2CC(=O)NCC3=CC=C(C=C3)C(=O)O)F

Isomeric SMILES

C1=CC(=CC2=C1C=CN2CC(=O)NCC3=CC=C(C=C3)C(=O)O)F

InChI

InChI=1S/C18H15FN2O3/c19-15-6-5-13-7-8-21(16(13)9-15)11-17(22)20-10-12-1-3-14(4-2-12)18(23)24/h1-9H,10-11H2,(H,20,22)(H,23,24)