N-(2-benzamidoethyl)-4-methyl-5-oxidanidyl-1,2,5-oxadiazol-5-ium-3-carboxamide

Systemtic Name: N-(2-benzamidoethyl)-4-methyl-5-oxidanidyl-1,2,5-oxadiazol-5-ium-3-carboxamide Openeye Name: N-(2-benzamidoethyl)-4-methyl-5-oxido-1,2,5-oxadiazol-5-ium-3-carboxamide CAS Name: N-(2-benzamidoethyl)-4-methyl-5-oxido-1,2,5-oxadiazol-5-ium-3-carboxamide IUPAC Name: N-(2-benzamidoethyl)-4-methyl-5-oxido-1,2,5-oxadiazol-5-ium-3-carboxamide Traditional Name: N-(2-benzamidoethyl)-4-methyl-5-oxido-furazan-5-ium-3-carboxamide Formula: C13H14N4O4 MolecularWeight: 290.27466

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](ON=C1C(=O)NCCNC(=O)C2=CC=CC=C2)[O-]

Isomeric SMILES

CC1=[N+](ON=C1C(=O)NCCNC(=O)C2=CC=CC=C2)[O-]

InChI

InChI=1S/C13H14N4O4/c1-9-11(16-21-17(9)20)13(19)15-8-7-14-12(18)10-5-3-2-4-6-10/h2-6H,7-8H2,1H3,(H,14,18)(H,15,19)