2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[[3-(2-methoxyphenyl)-1,2-oxazol-5-yl]methyl]-methyl-azanium

Systemtic Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[[3-(2-methoxyphenyl)-1,2-oxazol-5-yl]methyl]-methyl-azanium Openeye Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[[3-(2-methoxyphenyl)isoxazol-5-yl]methyl]-methyl-ammonium CAS Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[[3-(2-methoxyphenyl)-5-isoxazolyl]methyl]-methylammonium IUPAC Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[[3-(2-methoxyphenyl)-1,2-oxazol-5-yl]methyl]-methylazanium Traditional Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[[3-(2-methoxyphenyl)isoxazol-5-yl]methyl]-methyl-ammonium Formula: C21H23N2O4+ MolecularWeight: 367.41832

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC2=C(C=C1)OCCO2)CC3=CC(=NO3)C4=CC=CC=C4OC

Isomeric SMILES

C[NH+](CC1=CC2=C(C=C1)OCCO2)CC3=CC(=NO3)C4=CC=CC=C4OC

InChI

InChI=1S/C21H22N2O4/c1-23(13-15-7-8-20-21(11-15)26-10-9-25-20)14-16-12-18(22-27-16)17-5-3-4-6-19(17)24-2/h3-8,11-12H,9-10,13-14H2,1-2H3/p+1