1,3-benzodioxol-5-ylmethyl-[(1S)-1-(2-hydroxyphenyl)propyl]azanium

Systemtic Name: 1,3-benzodioxol-5-ylmethyl-[(1S)-1-(2-hydroxyphenyl)propyl]azanium Openeye Name: 1,3-benzodioxol-5-ylmethyl-[(1S)-1-(2-hydroxyphenyl)propyl]ammonium CAS Name: 1,3-benzodioxol-5-ylmethyl-[(1S)-1-(2-hydroxyphenyl)propyl]ammonium IUPAC Name: 1,3-benzodioxol-5-ylmethyl-[(1S)-1-(2-hydroxyphenyl)propyl]azanium Traditional Name: [(1S)-1-(2-hydroxyphenyl)propyl]-piperonyl-ammonium Formula: C17H20NO3+ MolecularWeight: 286.3456

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1O)[NH2+]CC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC[C@@H](C1=CC=CC=C1O)[NH2+]CC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C17H19NO3/c1-2-14(13-5-3-4-6-15(13)19)18-10-12-7-8-16-17(9-12)21-11-20-16/h3-9,14,18-19H,2,10-11H2,1H3/p+1/t14-/m0/s1