N-(hydroxymethyl)-N-(2-methylpropyl)-1-(5-phenethyl-1,2,4-oxadiazol-2-ium-2-yl)pyrrolidine-2-carboxamide

Systemtic Name: N-(hydroxymethyl)-N-(2-methylpropyl)-1-(5-phenethyl-1,2,4-oxadiazol-2-ium-2-yl)pyrrolidine-2-carboxamide Openeye Name: N-(hydroxymethyl)-N-isobutyl-1-(5-phenethyl-1,2,4-oxadiazol-2-ium-2-yl)pyrrolidine-2-carboxamide CAS Name: N-(hydroxymethyl)-N-(2-methylpropyl)-1-(5-phenethyl-1,2,4-oxadiazol-2-ium-2-yl)-2-pyrrolidinecarboxamide IUPAC Name: N-(hydroxymethyl)-N-(2-methylpropyl)-1-(5-phenethyl-1,2,4-oxadiazol-2-ium-2-yl)pyrrolidine-2-carboxamide Traditional Name: N-isobutyl-N-methylol-1-(5-phenethyl-1,2,4-oxadiazol-2-ium-2-yl)pyrrolidine-2-carboxamide Formula: C20H29N4O3+ MolecularWeight: 373.46926

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CO)C(=O)C1CCCN1[N+]2=CN=C(O2)CCC3=CC=CC=C3

Isomeric SMILES

CC(C)CN(CO)C(=O)C1CCCN1[N+]2=CN=C(O2)CCC3=CC=CC=C3

InChI

InChI=1S/C20H29N4O3/c1-16(2)13-22(15-25)20(26)18-9-6-12-23(18)24-14-21-19(27-24)11-10-17-7-4-3-5-8-17/h3-5,7-8,14,16,18,25H,6,9-13,15H2,1-2H3/q+1