1-[[6-(chloromethyl)pyridin-2-yl]methyl]-5-fluoranyl-indole-3-carboxylic acid

Systemtic Name: 1-[[6-(chloromethyl)pyridin-2-yl]methyl]-5-fluoranyl-indole-3-carboxylic acid Openeye Name: 1-[[6-(chloromethyl)-2-pyridyl]methyl]-5-fluoro-indole-3-carboxylic acid CAS Name: 1-[[6-(chloromethyl)-2-pyridinyl]methyl]-5-fluoro-3-indolecarboxylic acid IUPAC Name: 1-[[6-(chloromethyl)pyridin-2-yl]methyl]-5-fluoroindole-3-carboxylic acid Traditional Name: 1-[[6-(chloromethyl)-2-pyridyl]methyl]-5-fluoro-indole-3-carboxylic acid Formula: C16H12ClFN2O2 MolecularWeight: 318.730083

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=NC(=C1)CCl)CN2C=C(C3=C2C=CC(=C3)F)C(=O)O

Isomeric SMILES

C1=CC(=NC(=C1)CCl)CN2C=C(C3=C2C=CC(=C3)F)C(=O)O

InChI

InChI=1S/C16H12ClFN2O2/c17-7-11-2-1-3-12(19-11)8-20-9-14(16(21)22)13-6-10(18)4-5-15(13)20/h1-6,9H,7-8H2,(H,21,22)