5-[(6-oxidanyl-1,2,3,4-tetrahydroisoquinolin-1-yl)methyl]benzene-1,2,3-triol

Systemtic Name: 5-[(6-oxidanyl-1,2,3,4-tetrahydroisoquinolin-1-yl)methyl]benzene-1,2,3-triol Openeye Name: 5-[(6-hydroxy-1,2,3,4-tetrahydroisoquinolin-1-yl)methyl]benzene-1,2,3-triol CAS Name: 5-[(6-hydroxy-1,2,3,4-tetrahydroisoquinolin-1-yl)methyl]benzene-1,2,3-triol IUPAC Name: 5-[(6-hydroxy-1,2,3,4-tetrahydroisoquinolin-1-yl)methyl]benzene-1,2,3-triol Traditional Name: 5-[(6-hydroxy-1,2,3,4-tetrahydroisoquinolin-1-yl)methyl]pyrogallol Formula: C16H17NO4 MolecularWeight: 287.31048

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC(C2=C1C=C(C=C2)O)CC3=CC(=C(C(=C3)O)O)O

Isomeric SMILES

C1CNC(C2=C1C=C(C=C2)O)CC3=CC(=C(C(=C3)O)O)O

InChI

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