benzene; 4-(4-hydroxyphenyl)-1-methylsulfonyl-1,2,3,4-tetrahydroisoquinolin-7-ol

Systemtic Name: benzene; 4-(4-hydroxyphenyl)-1-methylsulfonyl-1,2,3,4-tetrahydroisoquinolin-7-ol Openeye Name: benzene; 4-(4-hydroxyphenyl)-1-methylsulfonyl-1,2,3,4-tetrahydroisoquinolin-7-ol CAS Name: benzene; 4-(4-hydroxyphenyl)-1-methylsulfonyl-1,2,3,4-tetrahydroisoquinolin-7-ol IUPAC Name: benzene; 4-(4-hydroxyphenyl)-1-methylsulfonyl-1,2,3,4-tetrahydroisoquinolin-7-ol Traditional Name: benzene; 4-(4-hydroxyphenyl)-1-mesyl-1,2,3,4-tetrahydroisoquinolin-7-ol Formula: C22H23NO4S MolecularWeight: 397.48732

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1C2=C(C=CC(=C2)O)C(CN1)C3=CC=C(C=C3)O.C1=CC=CC=C1

Isomeric SMILES

CS(=O)(=O)C1C2=C(C=CC(=C2)O)C(CN1)C3=CC=C(C=C3)O.C1=CC=CC=C1

InChI

InChI=1S/C16H17NO4S.C6H6/c1-22(20,21)16-14-8-12(19)6-7-13(14)15(9-17-16)10-2-4-11(18)5-3-10;1-2-4-6-5-3-1/h2-8,15-19H,9H2,1H3;1-6H