4-(2-azanylethanoyl)-3-(1-phenylpropan-2-yl)-2H-1,2,3-oxadiazol-3-ium-5-one

Systemtic Name: 4-(2-azanylethanoyl)-3-(1-phenylpropan-2-yl)-2H-1,2,3-oxadiazol-3-ium-5-one Openeye Name: 4-(2-aminoacetyl)-3-(1-methyl-2-phenyl-ethyl)-2H-oxadiazol-3-ium-5-one CAS Name: 4-(2-amino-1-oxoethyl)-3-(1-phenylpropan-2-yl)-2H-oxadiazol-3-ium-5-one IUPAC Name: 4-(2-aminoacetyl)-3-(1-phenylpropan-2-yl)-2H-oxadiazol-3-ium-5-one Traditional Name: 4-glycyl-3-(1-methyl-2-phenyl-ethyl)-2H-oxadiazol-3-ium-5-one Formula: C13H16N3O3+ MolecularWeight: 262.28444

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=CC=C1)[N+]2=C(C(=O)ON2)C(=O)CN

Isomeric SMILES

CC(CC1=CC=CC=C1)[N+]2=C(C(=O)ON2)C(=O)CN

InChI

InChI=1S/C13H15N3O3/c1-9(7-10-5-3-2-4-6-10)16-12(11(17)8-14)13(18)19-15-16/h2-6,9H,7-8,14H2,1H3/p+1