(3,5-dimethyl-1,2-oxazol-4-yl)-[4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-yl]methanone

Systemtic Name: (3,5-dimethyl-1,2-oxazol-4-yl)-[4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-yl]methanone Openeye Name: [4-[(E)-cinnamyl]piperazin-4-ium-1-yl]-(3,5-dimethylisoxazol-4-yl)methanone CAS Name: (3,5-dimethyl-4-isoxazolyl)-[4-[(E)-3-phenylprop-2-enyl]-1-piperazin-4-iumyl]methanone IUPAC Name: (3,5-dimethyl-1,2-oxazol-4-yl)-[4-[(E)-3-phenylprop-2-enyl]piperazin-4-ium-1-yl]methanone Traditional Name: [4-[(E)-cinnamyl]piperazin-4-ium-1-yl]-(3,5-dimethylisoxazol-4-yl)methanone Formula: C19H24N3O2+ MolecularWeight: 326.41276

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H23N3O2/c1-15-18(16(2)24-20-15)19(23)22-13-11-21(12-14-22)10-6-9-17-7-4-3-5-8-17/h3-9H,10-14H2,1-2H3/p+1/b9-6+