2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl-[(3-methylphenyl)methyl]azanium

Systemtic Name: 2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl-[(3-methylphenyl)methyl]azanium Openeye Name: 2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl-(m-tolylmethyl)ammonium CAS Name: 2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl-[(3-methylphenyl)methyl]ammonium IUPAC Name: 2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl-[(3-methylphenyl)methyl]azanium Traditional Name: 2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl-(3-methylbenzyl)ammonium Formula: C18H22NO2+ MolecularWeight: 284.37278

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C[NH2+]CCC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CC1=CC(=CC=C1)C[NH2+]CCC2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C18H21NO2/c1-14-3-2-4-16(11-14)13-19-8-7-15-5-6-17-18(12-15)21-10-9-20-17/h2-6,11-12,19H,7-10,13H2,1H3/p+1