(3-ethyl-5-methyl-1,2-oxazol-4-yl)-(4-phenethylpiperazin-4-ium-1-yl)methanone

Systemtic Name: (3-ethyl-5-methyl-1,2-oxazol-4-yl)-(4-phenethylpiperazin-4-ium-1-yl)methanone Openeye Name: (3-ethyl-5-methyl-isoxazol-4-yl)-(4-phenethylpiperazin-4-ium-1-yl)methanone CAS Name: (3-ethyl-5-methyl-4-isoxazolyl)-(4-phenethyl-1-piperazin-4-iumyl)methanone IUPAC Name: (3-ethyl-5-methyl-1,2-oxazol-4-yl)-(4-phenethylpiperazin-4-ium-1-yl)methanone Traditional Name: (3-ethyl-5-methyl-isoxazol-4-yl)-(4-phenethylpiperazin-4-ium-1-yl)methanone Formula: C19H26N3O2+ MolecularWeight: 328.42864

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NOC(=C1C(=O)N2CC[NH+](CC2)CCC3=CC=CC=C3)C

Isomeric SMILES

CCC1=NOC(=C1C(=O)N2CC[NH+](CC2)CCC3=CC=CC=C3)C

InChI

InChI=1S/C19H25N3O2/c1-3-17-18(15(2)24-20-17)19(23)22-13-11-21(12-14-22)10-9-16-7-5-4-6-8-16/h4-8H,3,9-14H2,1-2H3/p+1