1-[(4-phenylphenoxy)methyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol hydrochloride

Systemtic Name: 1-[(4-phenylphenoxy)methyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol hydrochloride Openeye Name: 1-[(4-phenylphenoxy)methyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol hydrochloride CAS Name: 1-[(4-phenylphenoxy)methyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol hydrochloride IUPAC Name: 1-[(4-phenylphenoxy)methyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol hydrochloride Traditional Name: 1-[(4-phenylphenoxy)methyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol hydrochloride Formula: C22H22ClNO3 MolecularWeight: 383.86798

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CNC(C2=CC(=C(C=C21)O)O)COC3=CC=C(C=C3)C4=CC=CC=C4.Cl

Isomeric SMILES

C1CNC(C2=CC(=C(C=C21)O)O)COC3=CC=C(C=C3)C4=CC=CC=C4.Cl

InChI

InChI=1S/C22H21NO3.ClH/c24-21-12-17-10-11-23-20(19(17)13-22(21)25)14-26-18-8-6-16(7-9-18)15-4-2-1-3-5-15;/h1-9,12-13,20,23-25H,10-11,14H2;1H