[(1S)-2-(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)-1-(3-methoxyphenyl)ethyl]-dimethyl-azanium

Systemtic Name: [(1S)-2-(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)-1-(3-methoxyphenyl)ethyl]-dimethyl-azanium Openeye Name: [(1S)-2-(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)-1-(3-methoxyphenyl)ethyl]-dimethyl-ammonium CAS Name: [(1S)-2-(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)-1-(3-methoxyphenyl)ethyl]-dimethylammonium IUPAC Name: [(1S)-2-(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)-1-(3-methoxyphenyl)ethyl]-dimethylazanium Traditional Name: [(1S)-2-(2,3-dihydro-1,4-benzodioxin-6-ylmethylamino)-1-(3-methoxyphenyl)ethyl]-dimethyl-ammonium Formula: C20H27N2O3+ MolecularWeight: 343.43998

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C(CNCC1=CC2=C(C=C1)OCCO2)C3=CC(=CC=C3)OC

Isomeric SMILES

C[NH+](C)[C@H](CNCC1=CC2=C(C=C1)OCCO2)C3=CC(=CC=C3)OC

InChI

InChI=1S/C20H26N2O3/c1-22(2)18(16-5-4-6-17(12-16)23-3)14-21-13-15-7-8-19-20(11-15)25-10-9-24-19/h4-8,11-12,18,21H,9-10,13-14H2,1-3H3/p+1/t18-/m1/s1