(2S)-2-[4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazin-1-ium-1-yl]-N-prop-2-enyl-propanamide

Systemtic Name: (2S)-2-[4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazin-1-ium-1-yl]-N-prop-2-enyl-propanamide Openeye Name: (2S)-N-allyl-2-[4-[(3-methylisoxazol-5-yl)methyl]piperazin-1-ium-1-yl]propanamide CAS Name: (2S)-2-[4-[(3-methyl-5-isoxazolyl)methyl]-1-piperazin-1-iumyl]-N-prop-2-enylpropanamide IUPAC Name: (2S)-2-[4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazin-1-ium-1-yl]-N-prop-2-enylpropanamide Traditional Name: (2S)-N-allyl-2-[4-[(3-methylisoxazol-5-yl)methyl]piperazin-1-ium-1-yl]propionamide Formula: C15H25N4O2+ MolecularWeight: 293.3846

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1)CN2CC[NH+](CC2)C(C)C(=O)NCC=C

Isomeric SMILES

CC1=NOC(=C1)CN2CC[NH+](CC2)[C@@H](C)C(=O)NCC=C

InChI

InChI=1S/C15H24N4O2/c1-4-5-16-15(20)13(3)19-8-6-18(7-9-19)11-14-10-12(2)17-21-14/h4,10,13H,1,5-9,11H2,2-3H3,(H,16,20)/p+1/t13-/m0/s1