N-(5-methyl-1,2-oxazol-3-yl)-4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-carboxamide

Systemtic Name: N-(5-methyl-1,2-oxazol-3-yl)-4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-carboxamide Openeye Name: 4-[(E)-cinnamyl]-N-(5-methylisoxazol-3-yl)piperazin-4-ium-1-carboxamide CAS Name: N-(5-methyl-3-isoxazolyl)-4-[(E)-3-phenylprop-2-enyl]-1-piperazin-4-iumcarboxamide IUPAC Name: N-(5-methyl-1,2-oxazol-3-yl)-4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-carboxamide Traditional Name: 4-[(E)-cinnamyl]-N-(5-methylisoxazol-3-yl)piperazin-4-ium-1-carboxamide Formula: C18H23N4O2+ MolecularWeight: 327.40082

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)N2CC[NH+](CC2)CC=CC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=NO1)NC(=O)N2CC[NH+](CC2)C/C=C/C3=CC=CC=C3

InChI

InChI=1S/C18H22N4O2/c1-15-14-17(20-24-15)19-18(23)22-12-10-21(11-13-22)9-5-8-16-6-3-2-4-7-16/h2-8,14H,9-13H2,1H3,(H,19,20,23)/p+1/b8-5+