3-[2-oxidanylidene-2-[(5-oxidanylidene-1-phenethyl-pyrrolidin-3-yl)amino]ethyl]-1,2,3-oxadiazol-3-ium-5-olate

Systemtic Name: 3-[2-oxidanylidene-2-[(5-oxidanylidene-1-phenethyl-pyrrolidin-3-yl)amino]ethyl]-1,2,3-oxadiazol-3-ium-5-olate Openeye Name: 3-[2-oxo-2-[(5-oxo-1-phenethyl-pyrrolidin-3-yl)amino]ethyl]oxadiazol-3-ium-5-olate CAS Name: 3-[2-oxo-2-[(5-oxo-1-phenethyl-3-pyrrolidinyl)amino]ethyl]-5-oxadiazol-3-iumolate IUPAC Name: 3-[2-oxo-2-[(5-oxo-1-phenethylpyrrolidin-3-yl)amino]ethyl]oxadiazol-3-ium-5-olate Traditional Name: 3-[2-keto-2-[(5-keto-1-phenethyl-pyrrolidin-3-yl)amino]ethyl]oxadiazol-3-ium-5-olate Formula: C16H18N4O4 MolecularWeight: 330.33852

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1=O)CCC2=CC=CC=C2)NC(=O)C[N+]3=NOC(=C3)[O-]

Isomeric SMILES

C1C(CN(C1=O)CCC2=CC=CC=C2)NC(=O)C[N+]3=NOC(=C3)[O-]

InChI

InChI=1S/C16H18N4O4/c21-14(10-20-11-16(23)24-18-20)17-13-8-15(22)19(9-13)7-6-12-4-2-1-3-5-12/h1-5,11,13H,6-10H2,(H-,17,18,21,23)