1-[[4-(1-benzothiophen-2-yl)phenyl]methyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol

Systemtic Name: 1-[[4-(1-benzothiophen-2-yl)phenyl]methyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol Openeye Name: 1-[[4-(benzothiophen-2-yl)phenyl]methyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol CAS Name: 1-[[4-(1-benzothiophen-2-yl)phenyl]methyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol IUPAC Name: 1-[[4-(1-benzothiophen-2-yl)phenyl]methyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol Traditional Name: 1-[4-(benzothiophen-2-yl)benzyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol Formula: C24H21NO2S MolecularWeight: 387.49404

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC(C2=CC(=C(C=C21)O)O)CC3=CC=C(C=C3)C4=CC5=CC=CC=C5S4

Isomeric SMILES

C1CNC(C2=CC(=C(C=C21)O)O)CC3=CC=C(C=C3)C4=CC5=CC=CC=C5S4

InChI

InChI=1S/C24H21NO2S/c26-21-12-17-9-10-25-20(19(17)14-22(21)27)11-15-5-7-16(8-6-15)24-13-18-3-1-2-4-23(18)28-24/h1-8,12-14,20,25-27H,9-11H2