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

Systemtic Name: 1-[(4-methoxy-2-oxidanyl-phenyl)methyl]-4-[[3-(3-methoxyphenyl)-1,2-oxazol-5-yl]methyl]piperidin-1-ium-4-ol Openeye Name: 1-[(2-hydroxy-4-methoxy-phenyl)methyl]-4-[[3-(3-methoxyphenyl)isoxazol-5-yl]methyl]piperidin-1-ium-4-ol CAS Name: 1-[(2-hydroxy-4-methoxyphenyl)methyl]-4-[[3-(3-methoxyphenyl)-5-isoxazolyl]methyl]-4-piperidin-1-iumol IUPAC Name: 1-[(2-hydroxy-4-methoxyphenyl)methyl]-4-[[3-(3-methoxyphenyl)-1,2-oxazol-5-yl]methyl]piperidin-1-ium-4-ol Traditional Name: 1-(2-hydroxy-4-methoxy-benzyl)-4-[[3-(3-methoxyphenyl)isoxazol-5-yl]methyl]piperidin-1-ium-4-ol Formula: C24H29N2O5+ MolecularWeight: 425.49746

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C[NH+]2CCC(CC2)(CC3=CC(=NO3)C4=CC(=CC=C4)OC)O)O

Isomeric SMILES

COC1=CC(=C(C=C1)C[NH+]2CCC(CC2)(CC3=CC(=NO3)C4=CC(=CC=C4)OC)O)O

InChI

InChI=1S/C24H28N2O5/c1-29-19-5-3-4-17(12-19)22-13-21(31-25-22)15-24(28)8-10-26(11-9-24)16-18-6-7-20(30-2)14-23(18)27/h3-7,12-14,27-28H,8-11,15-16H2,1-2H3/p+1