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

Systemtic Name: 1-[(2-oxidanylphenoxy)methyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol hydrochloride Openeye Name: 1-[(2-hydroxyphenoxy)methyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol hydrochloride CAS Name: 1-[(2-hydroxyphenoxy)methyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol hydrochloride IUPAC Name: 1-[(2-hydroxyphenoxy)methyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol hydrochloride Traditional Name: 1-[(2-hydroxyphenoxy)methyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol hydrochloride Formula: C16H18ClNO4 MolecularWeight: 323.77142

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC(C2=CC(=C(C=C21)O)O)COC3=CC=CC=C3O.Cl

Isomeric SMILES

C1CNC(C2=CC(=C(C=C21)O)O)COC3=CC=CC=C3O.Cl

InChI

InChI=1S/C16H17NO4.ClH/c18-13-3-1-2-4-16(13)21-9-12-11-8-15(20)14(19)7-10(11)5-6-17-12;/h1-4,7-8,12,17-20H,5-6,9H2;1H