[(2S,4S)-4-(1,3-benzodioxol-5-yl)-2-methyl-1,3-dioxolan-2-yl]methylazanium

Systemtic Name: [(2S,4S)-4-(1,3-benzodioxol-5-yl)-2-methyl-1,3-dioxolan-2-yl]methylazanium Openeye Name: [(2S,4S)-4-(1,3-benzodioxol-5-yl)-2-methyl-1,3-dioxolan-2-yl]methylammonium CAS Name: [(2S,4S)-4-(1,3-benzodioxol-5-yl)-2-methyl-1,3-dioxolan-2-yl]methylammonium IUPAC Name: [(2S,4S)-4-(1,3-benzodioxol-5-yl)-2-methyl-1,3-dioxolan-2-yl]methylazanium Traditional Name: [(2S,4S)-4-(1,3-benzodioxol-5-yl)-2-methyl-1,3-dioxolan-2-yl]methylammonium Formula: C12H16NO4+ MolecularWeight: 238.25974

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(OCC(O1)C2=CC3=C(C=C2)OCO3)C[NH3+]

Isomeric SMILES

C[C@@]1(OC[C@@H](O1)C2=CC3=C(C=C2)OCO3)C[NH3+]

InChI

InChI=1S/C12H15NO4/c1-12(6-13)16-5-11(17-12)8-2-3-9-10(4-8)15-7-14-9/h2-4,11H,5-7,13H2,1H3/p+1/t11-,12+/m1/s1