(2R,5S)-2-(1,3-benzodioxol-5-yl)-5-methyl-morpholin-4-ium

Systemtic Name: (2R,5S)-2-(1,3-benzodioxol-5-yl)-5-methyl-morpholin-4-ium Openeye Name: (2R,5S)-2-(1,3-benzodioxol-5-yl)-5-methyl-morpholin-4-ium CAS Name: (2R,5S)-2-(1,3-benzodioxol-5-yl)-5-methylmorpholin-4-ium IUPAC Name: (2R,5S)-2-(1,3-benzodioxol-5-yl)-5-methylmorpholin-4-ium Traditional Name: (2R,5S)-2-(1,3-benzodioxol-5-yl)-5-methyl-morpholin-4-ium Formula: C12H16NO3+ MolecularWeight: 222.26034

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Descriptors Computed from Structure

Canonical SMILES:

CC1COC(C[NH2+]1)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

C[C@H]1CO[C@@H](C[NH2+]1)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C12H15NO3/c1-8-6-14-12(5-13-8)9-2-3-10-11(4-9)16-7-15-10/h2-4,8,12-13H,5-7H2,1H3/p+1/t8-,12-/m0/s1