N-[[(3R)-1-cyclohexylpiperidin-1-ium-3-yl]methyl]-5-fluoranyl-N-(pyridin-3-ylmethyl)-1H-indole-2-carboxamide

Systemtic Name: N-[[(3R)-1-cyclohexylpiperidin-1-ium-3-yl]methyl]-5-fluoranyl-N-(pyridin-3-ylmethyl)-1H-indole-2-carboxamide Openeye Name: N-[[(3R)-1-cyclohexylpiperidin-1-ium-3-yl]methyl]-5-fluoro-N-(3-pyridylmethyl)-1H-indole-2-carboxamide CAS Name: N-[[(3R)-1-cyclohexyl-3-piperidin-1-iumyl]methyl]-5-fluoro-N-(3-pyridinylmethyl)-1H-indole-2-carboxamide IUPAC Name: N-[[(3R)-1-cyclohexylpiperidin-1-ium-3-yl]methyl]-5-fluoro-N-(pyridin-3-ylmethyl)-1H-indole-2-carboxamide Traditional Name: N-[[(3R)-1-cyclohexylpiperidin-1-ium-3-yl]methyl]-5-fluoro-N-(3-pyridylmethyl)-1H-indole-2-carboxamide Formula: C27H34FN4O+ MolecularWeight: 449.583463

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)[NH+]2CCCC(C2)CN(CC3=CN=CC=C3)C(=O)C4=CC5=C(N4)C=CC(=C5)F

Isomeric SMILES

C1CCC(CC1)[NH+]2CCC[C@@H](C2)CN(CC3=CN=CC=C3)C(=O)C4=CC5=C(N4)C=CC(=C5)F

InChI

InChI=1S/C27H33FN4O/c28-23-10-11-25-22(14-23)15-26(30-25)27(33)32(17-20-6-4-12-29-16-20)19-21-7-5-13-31(18-21)24-8-2-1-3-9-24/h4,6,10-12,14-16,21,24,30H,1-3,5,7-9,13,17-19H2/p+1/t21-/m0/s1