N-[(2S)-butan-2-yl]-5-[3-(2-methylpropyl)-1,2,4-oxadiazol-5-yl]pyridin-1-ium-2-amine

Systemtic Name: N-[(2S)-butan-2-yl]-5-[3-(2-methylpropyl)-1,2,4-oxadiazol-5-yl]pyridin-1-ium-2-amine Openeye Name: 5-(3-isobutyl-1,2,4-oxadiazol-5-yl)-N-[(1S)-1-methylpropyl]pyridin-1-ium-2-amine CAS Name: N-[(2S)-butan-2-yl]-5-[3-(2-methylpropyl)-1,2,4-oxadiazol-5-yl]-2-pyridin-1-iumamine IUPAC Name: N-[(2S)-butan-2-yl]-5-[3-(2-methylpropyl)-1,2,4-oxadiazol-5-yl]pyridin-1-ium-2-amine Traditional Name: [5-(3-isobutyl-1,2,4-oxadiazol-5-yl)pyridin-1-ium-2-yl]-[(1S)-1-methylpropyl]amine Formula: C15H23N4O+ MolecularWeight: 275.36932

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H22N4O/c1-5-11(4)17-13-7-6-12(9-16-13)15-18-14(19-20-15)8-10(2)3/h6-7,9-11H,5,8H2,1-4H3,(H,16,17)/p+1/t11-/m0/s1