1-(6-bromanyl-1,3-benzodioxol-5-yl)-1,2,3,4-tetrahydroisoquinoline-6,7-diol hydrochloride

Systemtic Name: 1-(6-bromanyl-1,3-benzodioxol-5-yl)-1,2,3,4-tetrahydroisoquinoline-6,7-diol hydrochloride Openeye Name: 1-(6-bromo-1,3-benzodioxol-5-yl)-1,2,3,4-tetrahydroisoquinoline-6,7-diol hydrochloride CAS Name: 1-(6-bromo-1,3-benzodioxol-5-yl)-1,2,3,4-tetrahydroisoquinoline-6,7-diol hydrochloride IUPAC Name: 1-(6-bromo-1,3-benzodioxol-5-yl)-1,2,3,4-tetrahydroisoquinoline-6,7-diol hydrochloride Traditional Name: 1-(6-bromo-1,3-benzodioxol-5-yl)-1,2,3,4-tetrahydroisoquinoline-6,7-diol hydrochloride Formula: C16H15BrClNO4 MolecularWeight: 400.6516

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC(C2=CC(=C(C=C21)O)O)C3=CC4=C(C=C3Br)OCO4.Cl

Isomeric SMILES

C1CNC(C2=CC(=C(C=C21)O)O)C3=CC4=C(C=C3Br)OCO4.Cl

InChI

InChI=1S/C16H14BrNO4.ClH/c17-11-6-15-14(21-7-22-15)5-10(11)16-9-4-13(20)12(19)3-8(9)1-2-18-16;/h3-6,16,18-20H,1-2,7H2;1H