5-methyl-4-[[4-(6-methylpyridin-1-ium-2-yl)piperazin-1-yl]methyl]-2-(3-phenoxyphenyl)-1,3-oxazole

Systemtic Name: 5-methyl-4-[[4-(6-methylpyridin-1-ium-2-yl)piperazin-1-yl]methyl]-2-(3-phenoxyphenyl)-1,3-oxazole Openeye Name: 5-methyl-4-[[4-(6-methylpyridin-1-ium-2-yl)piperazin-1-yl]methyl]-2-(3-phenoxyphenyl)oxazole CAS Name: 5-methyl-4-[[4-(6-methyl-2-pyridin-1-iumyl)-1-piperazinyl]methyl]-2-(3-phenoxyphenyl)oxazole IUPAC Name: 5-methyl-4-[[4-(6-methylpyridin-1-ium-2-yl)piperazin-1-yl]methyl]-2-(3-phenoxyphenyl)-1,3-oxazole Traditional Name: 5-methyl-4-[[4-(6-methylpyridin-1-ium-2-yl)piperazino]methyl]-2-(3-phenoxyphenyl)oxazole Formula: C27H29N4O2+ MolecularWeight: 441.54476

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[NH+]C(=CC=C1)N2CCN(CC2)CC3=C(OC(=N3)C4=CC(=CC=C4)OC5=CC=CC=C5)C

Isomeric SMILES

CC1=[NH+]C(=CC=C1)N2CCN(CC2)CC3=C(OC(=N3)C4=CC(=CC=C4)OC5=CC=CC=C5)C

InChI

InChI=1S/C27H28N4O2/c1-20-8-6-13-26(28-20)31-16-14-30(15-17-31)19-25-21(2)32-27(29-25)22-9-7-12-24(18-22)33-23-10-4-3-5-11-23/h3-13,18H,14-17,19H2,1-2H3/p+1