1-cyclopentyl-4-[[2-(furan-2-yl)-5-methyl-1,3-oxazol-4-yl]methyl]piperazin-4-ium-2-one

Systemtic Name: 1-cyclopentyl-4-[[2-(furan-2-yl)-5-methyl-1,3-oxazol-4-yl]methyl]piperazin-4-ium-2-one Openeye Name: 1-cyclopentyl-4-[[2-(2-furyl)-5-methyl-oxazol-4-yl]methyl]piperazin-4-ium-2-one CAS Name: 1-cyclopentyl-4-[[2-(2-furanyl)-5-methyl-4-oxazolyl]methyl]-2-piperazin-4-iumone IUPAC Name: 1-cyclopentyl-4-[[2-(furan-2-yl)-5-methyl-1,3-oxazol-4-yl]methyl]piperazin-4-ium-2-one Traditional Name: 1-cyclopentyl-4-[[2-(2-furyl)-5-methyl-oxazol-4-yl]methyl]piperazin-4-ium-2-one Formula: C18H24N3O3+ MolecularWeight: 330.40146

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(O1)C2=CC=CO2)C[NH+]3CCN(C(=O)C3)C4CCCC4

Isomeric SMILES

CC1=C(N=C(O1)C2=CC=CO2)C[NH+]3CCN(C(=O)C3)C4CCCC4

InChI

InChI=1S/C18H23N3O3/c1-13-15(19-18(24-13)16-7-4-10-23-16)11-20-8-9-21(17(22)12-20)14-5-2-3-6-14/h4,7,10,14H,2-3,5-6,8-9,11-12H2,1H3/p+1