N-[1-[(1-cyclohexyl-1,2,3,4-tetrazol-5-yl)methyl]piperidin-1-ium-4-yl]-4-fluoranyl-benzamide

Systemtic Name: N-[1-[(1-cyclohexyl-1,2,3,4-tetrazol-5-yl)methyl]piperidin-1-ium-4-yl]-4-fluoranyl-benzamide Openeye Name: N-[1-[(1-cyclohexyltetrazol-5-yl)methyl]piperidin-1-ium-4-yl]-4-fluoro-benzamide CAS Name: N-[1-[(1-cyclohexyl-5-tetrazolyl)methyl]-4-piperidin-1-iumyl]-4-fluorobenzamide IUPAC Name: N-[1-[(1-cyclohexyltetrazol-5-yl)methyl]piperidin-1-ium-4-yl]-4-fluorobenzamide Traditional Name: N-[1-[(1-cyclohexyltetrazol-5-yl)methyl]piperidin-1-ium-4-yl]-4-fluoro-benzamide Formula: C20H28FN6O+ MolecularWeight: 387.474323

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=NN=N2)C[NH+]3CCC(CC3)NC(=O)C4=CC=C(C=C4)F

Isomeric SMILES

C1CCC(CC1)N2C(=NN=N2)C[NH+]3CCC(CC3)NC(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C20H27FN6O/c21-16-8-6-15(7-9-16)20(28)22-17-10-12-26(13-11-17)14-19-23-24-25-27(19)18-4-2-1-3-5-18/h6-9,17-18H,1-5,10-14H2,(H,22,28)/p+1