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

Systemtic Name: [(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-[(3-hydroxyphenyl)methyl]azanium Openeye Name: [(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-[(3-hydroxyphenyl)methyl]ammonium CAS Name: [(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-[(3-hydroxyphenyl)methyl]ammonium IUPAC Name: [(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-[(3-hydroxyphenyl)methyl]azanium Traditional Name: [(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-(3-hydroxybenzyl)ammonium Formula: C16H18NO3+ MolecularWeight: 272.31902

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC=CC=C2O1)C[NH2+]CC3=CC(=CC=C3)O

Isomeric SMILES

C1[C@@H](OC2=CC=CC=C2O1)C[NH2+]CC3=CC(=CC=C3)O

InChI

InChI=1S/C16H17NO3/c18-13-5-3-4-12(8-13)9-17-10-14-11-19-15-6-1-2-7-16(15)20-14/h1-8,14,17-18H,9-11H2/p+1/t14-/m0/s1