5-[2-(2-benzamidocyclohexyl)ethanoyl]-3-(cyclopropylmethyl)-2-oxidanylidene-1,3,4-oxadiazol-3-ium-3-carboxamide

Systemtic Name: 5-[2-(2-benzamidocyclohexyl)ethanoyl]-3-(cyclopropylmethyl)-2-oxidanylidene-1,3,4-oxadiazol-3-ium-3-carboxamide Openeye Name: 5-[2-(2-benzamidocyclohexyl)acetyl]-3-(cyclopropylmethyl)-2-oxo-1,3,4-oxadiazol-3-ium-3-carboxamide CAS Name: 5-[2-(2-benzamidocyclohexyl)-1-oxoethyl]-3-(cyclopropylmethyl)-2-oxo-1,3,4-oxadiazol-3-ium-3-carboxamide IUPAC Name: 5-[2-(2-benzamidocyclohexyl)acetyl]-3-(cyclopropylmethyl)-2-oxo-1,3,4-oxadiazol-3-ium-3-carboxamide Traditional Name: 5-[2-(2-benzamidocyclohexyl)acetyl]-3-(cyclopropylmethyl)-2-keto-1,3,4-oxadiazol-3-ium-3-carboxamide Formula: C22H27N4O5+ MolecularWeight: 427.47358

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)CC(=O)C2=N[N+](C(=O)O2)(CC3CC3)C(=O)N)NC(=O)C4=CC=CC=C4

Isomeric SMILES

C1CCC(C(C1)CC(=O)C2=N[N+](C(=O)O2)(CC3CC3)C(=O)N)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H26N4O5/c23-21(29)26(13-14-10-11-14)22(30)31-20(25-26)18(27)12-16-8-4-5-9-17(16)24-19(28)15-6-2-1-3-7-15/h1-3,6-7,14,16-17H,4-5,8-13H2,(H2-,23,24,28,29)/p+1