4-[[3-(3-methoxyphenyl)-1,2-oxazol-5-yl]methyl]-1-[(2-methylphenyl)methyl]piperidin-1-ium-4-ol

Systemtic Name: 4-[[3-(3-methoxyphenyl)-1,2-oxazol-5-yl]methyl]-1-[(2-methylphenyl)methyl]piperidin-1-ium-4-ol Openeye Name: 4-[[3-(3-methoxyphenyl)isoxazol-5-yl]methyl]-1-(o-tolylmethyl)piperidin-1-ium-4-ol CAS Name: 4-[[3-(3-methoxyphenyl)-5-isoxazolyl]methyl]-1-[(2-methylphenyl)methyl]-4-piperidin-1-iumol IUPAC Name: 4-[[3-(3-methoxyphenyl)-1,2-oxazol-5-yl]methyl]-1-[(2-methylphenyl)methyl]piperidin-1-ium-4-ol Traditional Name: 4-[[3-(3-methoxyphenyl)isoxazol-5-yl]methyl]-1-(2-methylbenzyl)piperidin-1-ium-4-ol Formula: C24H29N2O3+ MolecularWeight: 393.49866

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C[NH+]2CCC(CC2)(CC3=CC(=NO3)C4=CC(=CC=C4)OC)O

Isomeric SMILES

CC1=CC=CC=C1C[NH+]2CCC(CC2)(CC3=CC(=NO3)C4=CC(=CC=C4)OC)O

InChI

InChI=1S/C24H28N2O3/c1-18-6-3-4-7-20(18)17-26-12-10-24(27,11-13-26)16-22-15-23(25-29-22)19-8-5-9-21(14-19)28-2/h3-9,14-15,27H,10-13,16-17H2,1-2H3/p+1