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

Systemtic Name: [4-(furan-2-ylmethyl)piperazin-4-ium-1-yl]-(5-methyl-3-phenyl-1,2-oxazol-4-yl)methanone Openeye Name: [4-(2-furylmethyl)piperazin-4-ium-1-yl]-(5-methyl-3-phenyl-isoxazol-4-yl)methanone CAS Name: [4-(2-furanylmethyl)-1-piperazin-4-iumyl]-(5-methyl-3-phenyl-4-isoxazolyl)methanone IUPAC Name: [4-(furan-2-ylmethyl)piperazin-4-ium-1-yl]-(5-methyl-3-phenyl-1,2-oxazol-4-yl)methanone Traditional Name: [4-(2-furfuryl)piperazin-4-ium-1-yl]-(5-methyl-3-phenyl-isoxazol-4-yl)methanone Formula: C20H22N3O3+ MolecularWeight: 352.40698

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)N3CC[NH+](CC3)CC4=CC=CO4

Isomeric SMILES

CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)N3CC[NH+](CC3)CC4=CC=CO4

InChI

InChI=1S/C20H21N3O3/c1-15-18(19(21-26-15)16-6-3-2-4-7-16)20(24)23-11-9-22(10-12-23)14-17-8-5-13-25-17/h2-8,13H,9-12,14H2,1H3/p+1