1-(4-propan-2-ylsulfonylphenyl)-1,2,3,4-tetrahydroisoquinoline-6,7-diol

Systemtic Name: 1-(4-propan-2-ylsulfonylphenyl)-1,2,3,4-tetrahydroisoquinoline-6,7-diol Openeye Name: 1-(4-isopropylsulfonylphenyl)-1,2,3,4-tetrahydroisoquinoline-6,7-diol CAS Name: 1-(4-propan-2-ylsulfonylphenyl)-1,2,3,4-tetrahydroisoquinoline-6,7-diol IUPAC Name: 1-(4-propan-2-ylsulfonylphenyl)-1,2,3,4-tetrahydroisoquinoline-6,7-diol Traditional Name: 1-(4-isopropylsulfonylphenyl)-1,2,3,4-tetrahydroisoquinoline-6,7-diol Formula: C18H21NO4S MolecularWeight: 347.42864

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)C1=CC=C(C=C1)C2C3=CC(=C(C=C3CCN2)O)O

Isomeric SMILES

CC(C)S(=O)(=O)C1=CC=C(C=C1)C2C3=CC(=C(C=C3CCN2)O)O

InChI

InChI=1S/C18H21NO4S/c1-11(2)24(22,23)14-5-3-12(4-6-14)18-15-10-17(21)16(20)9-13(15)7-8-19-18/h3-6,9-11,18-21H,7-8H2,1-2H3