6-[(2-bromanyl-4-methoxy-6-oxidanyl-phenyl)methylamino]cyclohex-4-ene-1,2,3-triol

Systemtic Name: 6-[(2-bromanyl-4-methoxy-6-oxidanyl-phenyl)methylamino]cyclohex-4-ene-1,2,3-triol Openeye Name: 6-[(2-bromo-6-hydroxy-4-methoxy-phenyl)methylamino]cyclohex-4-ene-1,2,3-triol CAS Name: 6-[(2-bromo-6-hydroxy-4-methoxyphenyl)methylamino]cyclohex-4-ene-1,2,3-triol IUPAC Name: 6-[(2-bromo-6-hydroxy-4-methoxyphenyl)methylamino]cyclohex-4-ene-1,2,3-triol Traditional Name: 6-[(2-bromo-6-hydroxy-4-methoxy-benzyl)amino]cyclohex-4-ene-1,2,3-triol Formula: C14H18BrNO5 MolecularWeight: 360.20042

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C(=C1)Br)CNC2C=CC(C(C2O)O)O)O

Isomeric SMILES

COC1=CC(=C(C(=C1)Br)CNC2C=CC(C(C2O)O)O)O

InChI

InChI=1S/C14H18BrNO5/c1-21-7-4-9(15)8(12(18)5-7)6-16-10-2-3-11(17)14(20)13(10)19/h2-5,10-11,13-14,16-20H,6H2,1H3