2-[4-(1-pyridazin-4-ylpiperidin-1-ium-1-yl)cyclohexyl]ethanoic acid

Systemtic Name: 2-[4-(1-pyridazin-4-ylpiperidin-1-ium-1-yl)cyclohexyl]ethanoic acid Openeye Name: 2-[4-(1-pyridazin-4-ylpiperidin-1-ium-1-yl)cyclohexyl]acetic acid CAS Name: 2-[4-[1-(4-pyridazinyl)-1-piperidin-1-iumyl]cyclohexyl]acetic acid IUPAC Name: 2-[4-(1-pyridazin-4-ylpiperidin-1-ium-1-yl)cyclohexyl]acetic acid Traditional Name: 2-[4-(1-pyridazin-4-ylpiperidin-1-ium-1-yl)cyclohexyl]acetic acid Formula: C17H26N3O2+ MolecularWeight: 304.40724

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[N+](CC1)(C2CCC(CC2)CC(=O)O)C3=CN=NC=C3

Isomeric SMILES

C1CC[N+](CC1)(C2CCC(CC2)CC(=O)O)C3=CN=NC=C3

InChI

InChI=1S/C17H25N3O2/c21-17(22)12-14-4-6-15(7-5-14)20(10-2-1-3-11-20)16-8-9-18-19-13-16/h8-9,13-15H,1-7,10-12H2/p+1