[(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxidanyl-ethyl]-phenethyl-azanium

Systemtic Name: [(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxidanyl-ethyl]-phenethyl-azanium Openeye Name: [(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-hydroxy-ethyl]-phenethyl-ammonium CAS Name: [(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-hydroxyethyl]-phenethylammonium IUPAC Name: [(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-hydroxyethyl]-phenethylazanium Traditional Name: [(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-hydroxy-ethyl]-phenethyl-ammonium Formula: C18H22NO3+ MolecularWeight: 300.37218

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)C(C[NH2+]CCC3=CC=CC=C3)O

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)[C@@H](C[NH2+]CCC3=CC=CC=C3)O

InChI

InChI=1S/C18H21NO3/c20-16(13-19-9-8-14-4-2-1-3-5-14)15-6-7-17-18(12-15)22-11-10-21-17/h1-7,12,16,19-20H,8-11,13H2/p+1/t16-/m1/s1