2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[(2R)-3-[(3,4-dimethoxyphenyl)methoxy]-2-oxidanyl-propyl]-methyl-azanium

Systemtic Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[(2R)-3-[(3,4-dimethoxyphenyl)methoxy]-2-oxidanyl-propyl]-methyl-azanium Openeye Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[(2R)-3-[(3,4-dimethoxyphenyl)methoxy]-2-hydroxy-propyl]-methyl-ammonium CAS Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[(2R)-3-[(3,4-dimethoxyphenyl)methoxy]-2-hydroxypropyl]-methylammonium IUPAC Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[(2R)-3-[(3,4-dimethoxyphenyl)methoxy]-2-hydroxypropyl]-methylazanium Traditional Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[(2R)-2-hydroxy-3-veratryloxy-propyl]-methyl-ammonium Formula: C22H30NO6+ MolecularWeight: 404.4767

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC2=C(C=C1)OCCO2)CC(COCC3=CC(=C(C=C3)OC)OC)O

Isomeric SMILES

C[NH+](CC1=CC2=C(C=C1)OCCO2)C[C@H](COCC3=CC(=C(C=C3)OC)OC)O

InChI

InChI=1S/C22H29NO6/c1-23(12-16-4-7-20-22(10-16)29-9-8-28-20)13-18(24)15-27-14-17-5-6-19(25-2)21(11-17)26-3/h4-7,10-11,18,24H,8-9,12-15H2,1-3H3/p+1/t18-/m1/s1