[3-bromanyl-5-ethoxy-4-(2-ethylsulfonylethoxy)phenyl]methanamine

Systemtic Name: [3-bromanyl-5-ethoxy-4-(2-ethylsulfonylethoxy)phenyl]methanamine Openeye Name: [3-bromo-5-ethoxy-4-(2-ethylsulfonylethoxy)phenyl]methanamine CAS Name: [3-bromo-5-ethoxy-4-(2-ethylsulfonylethoxy)phenyl]methanamine IUPAC Name: [3-bromo-5-ethoxy-4-(2-ethylsulfonylethoxy)phenyl]methanamine Traditional Name: [3-bromo-4-(2-esylethoxy)-5-ethoxy-benzyl]amine Formula: C13H20BrNO4S MolecularWeight: 366.2712

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)CN)Br)OCCS(=O)(=O)CC

Isomeric SMILES

CCOC1=C(C(=CC(=C1)CN)Br)OCCS(=O)(=O)CC

InChI

InChI=1S/C13H20BrNO4S/c1-3-18-12-8-10(9-15)7-11(14)13(12)19-5-6-20(16,17)4-2/h7-8H,3-6,9,15H2,1-2H3