3-(2-methylpropyl)-2-oxidanylidene-5-pentanoyl-N-[1-(3-phenylpropyl)pyrrolidin-2-yl]-1,3,4-oxadiazol-3-ium-3-carboxamide

Systemtic Name: 3-(2-methylpropyl)-2-oxidanylidene-5-pentanoyl-N-[1-(3-phenylpropyl)pyrrolidin-2-yl]-1,3,4-oxadiazol-3-ium-3-carboxamide Openeye Name: 3-isobutyl-2-oxo-5-pentanoyl-N-[1-(3-phenylpropyl)pyrrolidin-2-yl]-1,3,4-oxadiazol-3-ium-3-carboxamide CAS Name: 3-(2-methylpropyl)-2-oxo-5-(1-oxopentyl)-N-[1-(3-phenylpropyl)-2-pyrrolidinyl]-1,3,4-oxadiazol-3-ium-3-carboxamide IUPAC Name: 3-(2-methylpropyl)-2-oxo-5-pentanoyl-N-[1-(3-phenylpropyl)pyrrolidin-2-yl]-1,3,4-oxadiazol-3-ium-3-carboxamide Traditional Name: 3-isobutyl-2-keto-N-[1-(3-phenylpropyl)pyrrolidin-2-yl]-5-valeryl-1,3,4-oxadiazol-3-ium-3-carboxamide Formula: C25H37N4O4+ MolecularWeight: 457.58568

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)C1=N[N+](C(=O)O1)(CC(C)C)C(=O)NC2CCCN2CCCC3=CC=CC=C3

Isomeric SMILES

CCCCC(=O)C1=N[N+](C(=O)O1)(CC(C)C)C(=O)NC2CCCN2CCCC3=CC=CC=C3

InChI

InChI=1S/C25H36N4O4/c1-4-5-14-21(30)23-27-29(18-19(2)3,25(32)33-23)24(31)26-22-15-10-17-28(22)16-9-13-20-11-7-6-8-12-20/h6-8,11-12,19,22H,4-5,9-10,13-18H2,1-3H3/p+1