ethanedioate; 5-(1-methylpiperidin-1-ium-4-yl)-3-propyl-1,2,4-oxadiazole

Systemtic Name: ethanedioate; 5-(1-methylpiperidin-1-ium-4-yl)-3-propyl-1,2,4-oxadiazole Openeye Name: 5-(1-methylpiperidin-1-ium-4-yl)-3-propyl-1,2,4-oxadiazole; oxalate CAS Name: 5-(1-methyl-4-piperidin-1-iumyl)-3-propyl-1,2,4-oxadiazole; oxalate IUPAC Name: 5-(1-methylpiperidin-1-ium-4-yl)-3-propyl-1,2,4-oxadiazole; oxalate Traditional Name: 5-(1-methylpiperidin-1-ium-4-yl)-3-propyl-1,2,4-oxadiazole; oxalate Formula: C24H40N6O6 MolecularWeight: 508.611

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NOC(=N1)C2CC[NH+](CC2)C.CCCC1=NOC(=N1)C2CC[NH+](CC2)C.C(=O)(C(=O)[O-])[O-]

Isomeric SMILES

CCCC1=NOC(=N1)C2CC[NH+](CC2)C.CCCC1=NOC(=N1)C2CC[NH+](CC2)C.C(=O)(C(=O)[O-])[O-]

InChI

InChI=1S/2C11H19N3O.C2H2O4/c2*1-3-4-10-12-11(15-13-10)9-5-7-14(2)8-6-9;3-1(4)2(5)6/h2*9H,3-8H2,1-2H3;(H,3,4)(H,5,6)