4-[[5-[3-(phenoxymethyl)-1,2,4-oxadiazol-5-yl]pyridin-1-ium-2-yl]amino]cyclohexan-1-ol

Systemtic Name: 4-[[5-[3-(phenoxymethyl)-1,2,4-oxadiazol-5-yl]pyridin-1-ium-2-yl]amino]cyclohexan-1-ol Openeye Name: 4-[[5-[3-(phenoxymethyl)-1,2,4-oxadiazol-5-yl]pyridin-1-ium-2-yl]amino]cyclohexanol CAS Name: 4-[[5-[3-(phenoxymethyl)-1,2,4-oxadiazol-5-yl]-2-pyridin-1-iumyl]amino]-1-cyclohexanol IUPAC Name: 4-[[5-[3-(phenoxymethyl)-1,2,4-oxadiazol-5-yl]pyridin-1-ium-2-yl]amino]cyclohexan-1-ol Traditional Name: 4-[[5-[3-(phenoxymethyl)-1,2,4-oxadiazol-5-yl]pyridin-1-ium-2-yl]amino]cyclohexanol Formula: C20H23N4O3+ MolecularWeight: 367.42162

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1NC2=[NH+]C=C(C=C2)C3=NC(=NO3)COC4=CC=CC=C4)O

Isomeric SMILES

C1CC(CCC1NC2=[NH+]C=C(C=C2)C3=NC(=NO3)COC4=CC=CC=C4)O

InChI

InChI=1S/C20H22N4O3/c25-16-9-7-15(8-10-16)22-18-11-6-14(12-21-18)20-23-19(24-27-20)13-26-17-4-2-1-3-5-17/h1-6,11-12,15-16,25H,7-10,13H2,(H,21,22)/p+1