N-[(2R)-1-methoxybutan-2-yl]-5-[3-(phenylmethyl)-1,2,4-oxadiazol-5-yl]pyridin-1-ium-2-amine

Systemtic Name: N-[(2R)-1-methoxybutan-2-yl]-5-[3-(phenylmethyl)-1,2,4-oxadiazol-5-yl]pyridin-1-ium-2-amine Openeye Name: 5-(3-benzyl-1,2,4-oxadiazol-5-yl)-N-[(1R)-1-(methoxymethyl)propyl]pyridin-1-ium-2-amine CAS Name: N-[(2R)-1-methoxybutan-2-yl]-5-[3-(phenylmethyl)-1,2,4-oxadiazol-5-yl]-2-pyridin-1-iumamine IUPAC Name: 5-(3-benzyl-1,2,4-oxadiazol-5-yl)-N-[(2R)-1-methoxybutan-2-yl]pyridin-1-ium-2-amine Traditional Name: [5-(3-benzyl-1,2,4-oxadiazol-5-yl)pyridin-1-ium-2-yl]-[(1R)-1-(methoxymethyl)propyl]amine Formula: C19H23N4O2+ MolecularWeight: 339.41152

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Descriptors Computed from Structure

Canonical SMILES:

CCC(COC)NC1=[NH+]C=C(C=C1)C2=NC(=NO2)CC3=CC=CC=C3

Isomeric SMILES

CC[C@H](COC)NC1=[NH+]C=C(C=C1)C2=NC(=NO2)CC3=CC=CC=C3

InChI

InChI=1S/C19H22N4O2/c1-3-16(13-24-2)21-17-10-9-15(12-20-17)19-22-18(23-25-19)11-14-7-5-4-6-8-14/h4-10,12,16H,3,11,13H2,1-2H3,(H,20,21)/p+1/t16-/m1/s1