3-ethyl-N-[(3S)-1-(1-methylpiperidin-1-ium-4-yl)piperidin-1-ium-3-yl]-1,2-oxazole-5-carboxamide

Systemtic Name: 3-ethyl-N-[(3S)-1-(1-methylpiperidin-1-ium-4-yl)piperidin-1-ium-3-yl]-1,2-oxazole-5-carboxamide Openeye Name: 3-ethyl-N-[(3S)-1-(1-methylpiperidin-1-ium-4-yl)piperidin-1-ium-3-yl]isoxazole-5-carboxamide CAS Name: 3-ethyl-N-[(3S)-1-(1-methyl-4-piperidin-1-iumyl)-3-piperidin-1-iumyl]-5-isoxazolecarboxamide IUPAC Name: 3-ethyl-N-[(3S)-1-(1-methylpiperidin-1-ium-4-yl)piperidin-1-ium-3-yl]-1,2-oxazole-5-carboxamide Traditional Name: 3-ethyl-N-[(3S)-1-(1-methylpiperidin-1-ium-4-yl)piperidin-1-ium-3-yl]isoxazole-5-carboxamide Formula: C17H30N4O2+2 MolecularWeight: 322.4457

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NOC(=C1)C(=O)NC2CCC[NH+](C2)C3CC[NH+](CC3)C

Isomeric SMILES

CCC1=NOC(=C1)C(=O)N[C@H]2CCC[NH+](C2)C3CC[NH+](CC3)C

InChI

InChI=1S/C17H28N4O2/c1-3-13-11-16(23-19-13)17(22)18-14-5-4-8-21(12-14)15-6-9-20(2)10-7-15/h11,14-15H,3-10,12H2,1-2H3,(H,18,22)/p+2/t14-/m0/s1