(2S)-2-ethyl-N-[2-(1,2-oxazol-3-ylamino)-2-oxidanylidene-ethyl]-N-(2-pyrrolidin-1-ium-1-ylethyl)hexanamide

Systemtic Name: (2S)-2-ethyl-N-[2-(1,2-oxazol-3-ylamino)-2-oxidanylidene-ethyl]-N-(2-pyrrolidin-1-ium-1-ylethyl)hexanamide Openeye Name: (2S)-2-ethyl-N-[2-(isoxazol-3-ylamino)-2-oxo-ethyl]-N-(2-pyrrolidin-1-ium-1-ylethyl)hexanamide CAS Name: (2S)-2-ethyl-N-[2-(3-isoxazolylamino)-2-oxoethyl]-N-[2-(1-pyrrolidin-1-iumyl)ethyl]hexanamide IUPAC Name: (2S)-2-ethyl-N-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl]-N-(2-pyrrolidin-1-ium-1-ylethyl)hexanamide Traditional Name: (2S)-2-ethyl-N-[2-(isoxazol-3-ylamino)-2-keto-ethyl]-N-(2-pyrrolidin-1-ium-1-ylethyl)hexanamide Formula: C19H33N4O3+ MolecularWeight: 365.49032

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)N(CC[NH+]1CCCC1)CC(=O)NC2=NOC=C2

Isomeric SMILES

CCCC[C@H](CC)C(=O)N(CC[NH+]1CCCC1)CC(=O)NC2=NOC=C2

InChI

InChI=1S/C19H32N4O3/c1-3-5-8-16(4-2)19(25)23(13-12-22-10-6-7-11-22)15-18(24)20-17-9-14-26-21-17/h9,14,16H,3-8,10-13,15H2,1-2H3,(H,20,21,24)/p+1/t16-/m0/s1