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

Systemtic Name: furan-2-yl-[4-[[5-methyl-2-(3-phenoxyphenyl)-1,3-oxazol-4-yl]methyl]piperazin-4-ium-1-yl]methanone Openeye Name: 2-furyl-[4-[[5-methyl-2-(3-phenoxyphenyl)oxazol-4-yl]methyl]piperazin-4-ium-1-yl]methanone CAS Name: 2-furanyl-[4-[[5-methyl-2-(3-phenoxyphenyl)-4-oxazolyl]methyl]-1-piperazin-4-iumyl]methanone IUPAC Name: furan-2-yl-[4-[[5-methyl-2-(3-phenoxyphenyl)-1,3-oxazol-4-yl]methyl]piperazin-4-ium-1-yl]methanone Traditional Name: 2-furyl-[4-[[5-methyl-2-(3-phenoxyphenyl)oxazol-4-yl]methyl]piperazin-4-ium-1-yl]methanone Formula: C26H26N3O4+ MolecularWeight: 444.50234

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(O1)C2=CC(=CC=C2)OC3=CC=CC=C3)C[NH+]4CCN(CC4)C(=O)C5=CC=CO5

Isomeric SMILES

CC1=C(N=C(O1)C2=CC(=CC=C2)OC3=CC=CC=C3)C[NH+]4CCN(CC4)C(=O)C5=CC=CO5

InChI

InChI=1S/C26H25N3O4/c1-19-23(18-28-12-14-29(15-13-28)26(30)24-11-6-16-31-24)27-25(32-19)20-7-5-10-22(17-20)33-21-8-3-2-4-9-21/h2-11,16-17H,12-15,18H2,1H3/p+1