[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-[(2S)-2-methylpentyl]azanium

Systemtic Name: [(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-[(2S)-2-methylpentyl]azanium Openeye Name: [(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-[(2S)-2-methylpentyl]ammonium CAS Name: [(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-[(2S)-2-methylpentyl]ammonium IUPAC Name: [(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-[(2S)-2-methylpentyl]azanium Traditional Name: [(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-[(2S)-2-methylpentyl]ammonium Formula: C15H24NO2+ MolecularWeight: 250.35656

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)C[NH2+]CC1COC2=CC=CC=C2O1

Isomeric SMILES

CCC[C@H](C)C[NH2+]C[C@H]1COC2=CC=CC=C2O1

InChI

InChI=1S/C15H23NO2/c1-3-6-12(2)9-16-10-13-11-17-14-7-4-5-8-15(14)18-13/h4-5,7-8,12-13,16H,3,6,9-11H2,1-2H3/p+1/t12-,13-/m0/s1