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

Systemtic Name: methyl 1-[(3-cyanophenyl)methyl]-5-fluoranyl-indole-2-carboxylate Openeye Name: methyl 1-[(3-cyanophenyl)methyl]-5-fluoro-indole-2-carboxylate CAS Name: 1-[(3-cyanophenyl)methyl]-5-fluoro-2-indolecarboxylic acid methyl ester IUPAC Name: methyl 1-[(3-cyanophenyl)methyl]-5-fluoroindole-2-carboxylate Traditional Name: 1-(3-cyanobenzyl)-5-fluoro-indole-2-carboxylic acid methyl ester Formula: C18H13FN2O2 MolecularWeight: 308.306423

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(N1CC3=CC=CC(=C3)C#N)C=CC(=C2)F

Isomeric SMILES

COC(=O)C1=CC2=C(N1CC3=CC=CC(=C3)C#N)C=CC(=C2)F

InChI

InChI=1S/C18H13FN2O2/c1-23-18(22)17-9-14-8-15(19)5-6-16(14)21(17)11-13-4-2-3-12(7-13)10-20/h2-9H,11H2,1H3