[5-(2,5-dimethoxyphenyl)-2-oxidanyl-phenyl]methyl-methyl-(1,2-oxazol-3-ylmethyl)azanium

Systemtic Name: [5-(2,5-dimethoxyphenyl)-2-oxidanyl-phenyl]methyl-methyl-(1,2-oxazol-3-ylmethyl)azanium Openeye Name: [5-(2,5-dimethoxyphenyl)-2-hydroxy-phenyl]methyl-(isoxazol-3-ylmethyl)-methyl-ammonium CAS Name: [5-(2,5-dimethoxyphenyl)-2-hydroxyphenyl]methyl-(3-isoxazolylmethyl)-methylammonium IUPAC Name: [5-(2,5-dimethoxyphenyl)-2-hydroxyphenyl]methyl-methyl-(1,2-oxazol-3-ylmethyl)azanium Traditional Name: [5-(2,5-dimethoxyphenyl)-2-hydroxy-benzyl]-(isoxazol-3-ylmethyl)-methyl-ammonium Formula: C20H23N2O4+ MolecularWeight: 355.40762

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=NOC=C1)CC2=C(C=CC(=C2)C3=C(C=CC(=C3)OC)OC)O

Isomeric SMILES

C[NH+](CC1=NOC=C1)CC2=C(C=CC(=C2)C3=C(C=CC(=C3)OC)OC)O

InChI

InChI=1S/C20H22N2O4/c1-22(13-16-8-9-26-21-16)12-15-10-14(4-6-19(15)23)18-11-17(24-2)5-7-20(18)25-3/h4-11,23H,12-13H2,1-3H3/p+1