N-[[(3R)-2,3-dihydro-1,4-benzoxathiin-3-yl]methyl]-2-(2,6-dimethoxyphenoxy)ethanamine

Systemtic Name: N-[[(3R)-2,3-dihydro-1,4-benzoxathiin-3-yl]methyl]-2-(2,6-dimethoxyphenoxy)ethanamine Openeye Name: N-[[(3R)-2,3-dihydro-1,4-benzoxathiin-3-yl]methyl]-2-(2,6-dimethoxyphenoxy)ethanamine CAS Name: N-[[(3R)-2,3-dihydro-1,4-benzoxathiin-3-yl]methyl]-2-(2,6-dimethoxyphenoxy)ethanamine IUPAC Name: N-[[(3R)-2,3-dihydro-1,4-benzoxathiin-3-yl]methyl]-2-(2,6-dimethoxyphenoxy)ethanamine Traditional Name: [(3R)-2,3-dihydro-1,4-benzoxathiin-3-yl]methyl-[2-(2,6-dimethoxyphenoxy)ethyl]amine Formula: C19H23NO4S MolecularWeight: 361.45522

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC=C1)OC)OCCNCC2COC3=CC=CC=C3S2

Isomeric SMILES

COC1=C(C(=CC=C1)OC)OCCNC[C@@H]2COC3=CC=CC=C3S2

InChI

InChI=1S/C19H23NO4S/c1-21-16-7-5-8-17(22-2)19(16)23-11-10-20-12-14-13-24-15-6-3-4-9-18(15)25-14/h3-9,14,20H,10-13H2,1-2H3/t14-/m1/s1