4-[(7-methoxy-2-methyl-8-oxidanyl-3,4-dihydro-1H-isoquinolin-1-yl)methyl]benzene-1,2-diol

Systemtic Name: 4-[(7-methoxy-2-methyl-8-oxidanyl-3,4-dihydro-1H-isoquinolin-1-yl)methyl]benzene-1,2-diol Openeye Name: 4-[(8-hydroxy-7-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)methyl]benzene-1,2-diol CAS Name: 4-[(8-hydroxy-7-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)methyl]benzene-1,2-diol IUPAC Name: 4-[(8-hydroxy-7-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)methyl]benzene-1,2-diol Traditional Name: 4-[(8-hydroxy-7-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)methyl]pyrocatechol Formula: C18H21NO4 MolecularWeight: 315.36364

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC2=C(C1CC3=CC(=C(C=C3)O)O)C(=C(C=C2)OC)O

Isomeric SMILES

CN1CCC2=C(C1CC3=CC(=C(C=C3)O)O)C(=C(C=C2)OC)O

InChI

InChI=1S/C18H21NO4/c1-19-8-7-12-4-6-16(23-2)18(22)17(12)13(19)9-11-3-5-14(20)15(21)10-11/h3-6,10,13,20-22H,7-9H2,1-2H3