(3-ethyl-5-methyl-1,2-oxazol-4-yl)-[4-(furan-2-ylmethyl)piperazin-4-ium-1-yl]methanone

Systemtic Name: (3-ethyl-5-methyl-1,2-oxazol-4-yl)-[4-(furan-2-ylmethyl)piperazin-4-ium-1-yl]methanone Openeye Name: (3-ethyl-5-methyl-isoxazol-4-yl)-[4-(2-furylmethyl)piperazin-4-ium-1-yl]methanone CAS Name: (3-ethyl-5-methyl-4-isoxazolyl)-[4-(2-furanylmethyl)-1-piperazin-4-iumyl]methanone IUPAC Name: (3-ethyl-5-methyl-1,2-oxazol-4-yl)-[4-(furan-2-ylmethyl)piperazin-4-ium-1-yl]methanone Traditional Name: (3-ethyl-5-methyl-isoxazol-4-yl)-[4-(2-furfuryl)piperazin-4-ium-1-yl]methanone Formula: C16H22N3O3+ MolecularWeight: 304.36418

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NOC(=C1C(=O)N2CC[NH+](CC2)CC3=CC=CO3)C

Isomeric SMILES

CCC1=NOC(=C1C(=O)N2CC[NH+](CC2)CC3=CC=CO3)C

InChI

InChI=1S/C16H21N3O3/c1-3-14-15(12(2)22-17-14)16(20)19-8-6-18(7-9-19)11-13-5-4-10-21-13/h4-5,10H,3,6-9,11H2,1-2H3/p+1