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

Systemtic Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[(1S)-1-(4-methylphenyl)ethyl]azanium Openeye Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[(1S)-1-(p-tolyl)ethyl]ammonium CAS Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[(1S)-1-(4-methylphenyl)ethyl]ammonium IUPAC Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[(1S)-1-(4-methylphenyl)ethyl]azanium Traditional Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[(1S)-1-(p-tolyl)ethyl]ammonium Formula: C18H22NO2+ MolecularWeight: 284.37278

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C)[NH2+]CC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CC1=CC=C(C=C1)[C@H](C)[NH2+]CC2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C18H21NO2/c1-13-3-6-16(7-4-13)14(2)19-12-15-5-8-17-18(11-15)21-10-9-20-17/h3-8,11,14,19H,9-10,12H2,1-2H3/p+1/t14-/m0/s1