1-[5-[3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]pyridin-1-ium-2-yl]piperidin-4-ol

Systemtic Name: 1-[5-[3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]pyridin-1-ium-2-yl]piperidin-4-ol Openeye Name: 1-[5-[3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]pyridin-1-ium-2-yl]piperidin-4-ol CAS Name: 1-[5-[3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]-2-pyridin-1-iumyl]-4-piperidinol IUPAC Name: 1-[5-[3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]pyridin-1-ium-2-yl]piperidin-4-ol Traditional Name: 1-[5-[3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]pyridin-1-ium-2-yl]piperidin-4-ol Formula: C18H18ClN4O2+ MolecularWeight: 357.81412

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1O)C2=[NH+]C=C(C=C2)C3=NC(=NO3)C4=CC(=CC=C4)Cl

Isomeric SMILES

C1CN(CCC1O)C2=[NH+]C=C(C=C2)C3=NC(=NO3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C18H17ClN4O2/c19-14-3-1-2-12(10-14)17-21-18(25-22-17)13-4-5-16(20-11-13)23-8-6-15(24)7-9-23/h1-5,10-11,15,24H,6-9H2/p+1