2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[(1S)-1-(5-methylthiophen-2-yl)ethyl]azanium

Systemtic Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[(1S)-1-(5-methylthiophen-2-yl)ethyl]azanium Openeye Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[(1S)-1-(5-methyl-2-thienyl)ethyl]ammonium CAS Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[(1S)-1-(5-methyl-2-thiophenyl)ethyl]ammonium IUPAC Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[(1S)-1-(5-methylthiophen-2-yl)ethyl]azanium Traditional Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[(1S)-1-(5-methyl-2-thienyl)ethyl]ammonium Formula: C16H20NO2S+ MolecularWeight: 290.4005

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C(C)[NH2+]CC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CC1=CC=C(S1)[C@H](C)[NH2+]CC2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C16H19NO2S/c1-11-3-6-16(20-11)12(2)17-10-13-4-5-14-15(9-13)19-8-7-18-14/h3-6,9,12,17H,7-8,10H2,1-2H3/p+1/t12-/m0/s1