N-[(5-fluoranyl-1H-indol-2-yl)methyl]-N-methyl-1-(2-piperidin-1-ium-1-ylethyl)-1,2,3-triazole-4-carboxamide

Systemtic Name: N-[(5-fluoranyl-1H-indol-2-yl)methyl]-N-methyl-1-(2-piperidin-1-ium-1-ylethyl)-1,2,3-triazole-4-carboxamide Openeye Name: N-[(5-fluoro-1H-indol-2-yl)methyl]-N-methyl-1-(2-piperidin-1-ium-1-ylethyl)triazole-4-carboxamide CAS Name: N-[(5-fluoro-1H-indol-2-yl)methyl]-N-methyl-1-[2-(1-piperidin-1-iumyl)ethyl]-4-triazolecarboxamide IUPAC Name: N-[(5-fluoro-1H-indol-2-yl)methyl]-N-methyl-1-(2-piperidin-1-ium-1-ylethyl)triazole-4-carboxamide Traditional Name: N-[(5-fluoro-1H-indol-2-yl)methyl]-N-methyl-1-(2-piperidin-1-ium-1-ylethyl)triazole-4-carboxamide Formula: C20H26FN6O+ MolecularWeight: 385.458443

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC2=C(N1)C=CC(=C2)F)C(=O)C3=CN(N=N3)CC[NH+]4CCCCC4

Isomeric SMILES

CN(CC1=CC2=C(N1)C=CC(=C2)F)C(=O)C3=CN(N=N3)CC[NH+]4CCCCC4

InChI

InChI=1S/C20H25FN6O/c1-25(13-17-12-15-11-16(21)5-6-18(15)22-17)20(28)19-14-27(24-23-19)10-9-26-7-3-2-4-8-26/h5-6,11-12,14,22H,2-4,7-10,13H2,1H3/p+1