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

Systemtic Name: [(2S,4S)-2-(1,3-benzodioxol-5-ylmethyl)-2-methyl-1,3-dioxolan-4-yl]methanamine Openeye Name: [(2S,4S)-2-(1,3-benzodioxol-5-ylmethyl)-2-methyl-1,3-dioxolan-4-yl]methanamine CAS Name: [(2S,4S)-2-(1,3-benzodioxol-5-ylmethyl)-2-methyl-1,3-dioxolan-4-yl]methanamine IUPAC Name: [(2S,4S)-2-(1,3-benzodioxol-5-ylmethyl)-2-methyl-1,3-dioxolan-4-yl]methanamine Traditional Name: [(2S,4S)-2-methyl-2-piperonyl-1,3-dioxolan-4-yl]methylamine Formula: C13H17NO4 MolecularWeight: 251.27838

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(OCC(O1)CN)CC2=CC3=C(C=C2)OCO3

Isomeric SMILES

C[C@@]1(OC[C@@H](O1)CN)CC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C13H17NO4/c1-13(17-7-10(6-14)18-13)5-9-2-3-11-12(4-9)16-8-15-11/h2-4,10H,5-8,14H2,1H3/t10-,13-/m0/s1