1-(aminomethyl)-3,4-dihydro-1H-isochromene-5,6-diol bromide

Systemtic Name: 1-(aminomethyl)-3,4-dihydro-1H-isochromene-5,6-diol bromide Openeye Name: 1-(aminomethyl)isochromane-5,6-diol bromide CAS Name: 1-(aminomethyl)-3,4-dihydro-1H-2-benzopyran-5,6-diol bromide IUPAC Name: 1-(aminomethyl)-3,4-dihydro-1H-isochromene-5,6-diol bromide Traditional Name: 1-(aminomethyl)isochroman-5,6-diol bromide Formula: C10H13BrNO3- MolecularWeight: 275.11912

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COC(C2=C1C(=C(C=C2)O)O)CN.[Br-]

Isomeric SMILES

C1COC(C2=C1C(=C(C=C2)O)O)CN.[Br-]

InChI

InChI=1S/C10H13NO3.BrH/c11-5-9-6-1-2-8(12)10(13)7(6)3-4-14-9;/h1-2,9,12-13H,3-5,11H2;1H/p-1