1-[(3-cyanophenyl)methyl]-5-fluoranyl-indole-2-carboxylic acid

Systemtic Name: 1-[(3-cyanophenyl)methyl]-5-fluoranyl-indole-2-carboxylic acid Openeye Name: 1-[(3-cyanophenyl)methyl]-5-fluoro-indole-2-carboxylic acid CAS Name: 1-[(3-cyanophenyl)methyl]-5-fluoro-2-indolecarboxylic acid IUPAC Name: 1-[(3-cyanophenyl)methyl]-5-fluoroindole-2-carboxylic acid Traditional Name: 1-(3-cyanobenzyl)-5-fluoro-indole-2-carboxylic acid Formula: C17H11FN2O2 MolecularWeight: 294.279843

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)CN2C3=C(C=C(C=C3)F)C=C2C(=O)O)C#N

Isomeric SMILES

C1=CC(=CC(=C1)CN2C3=C(C=C(C=C3)F)C=C2C(=O)O)C#N

InChI

InChI=1S/C17H11FN2O2/c18-14-4-5-15-13(7-14)8-16(17(21)22)20(15)10-12-3-1-2-11(6-12)9-19/h1-8H,10H2,(H,21,22)