4-(4-bromophenyl)-1-isoquinolin-5-ylsulfonyl-piperidin-4-ol

Systemtic Name: 4-(4-bromophenyl)-1-isoquinolin-5-ylsulfonyl-piperidin-4-ol Openeye Name: 4-(4-bromophenyl)-1-(5-isoquinolylsulfonyl)piperidin-4-ol CAS Name: 4-(4-bromophenyl)-1-(5-isoquinolinylsulfonyl)-4-piperidinol IUPAC Name: 4-(4-bromophenyl)-1-isoquinolin-5-ylsulfonylpiperidin-4-ol Traditional Name: 4-(4-bromophenyl)-1-(5-isoquinolylsulfonyl)piperidin-4-ol Formula: C20H19BrN2O3S MolecularWeight: 447.34546

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(C2=CC=C(C=C2)Br)O)S(=O)(=O)C3=CC=CC4=C3C=CN=C4

Isomeric SMILES

C1CN(CCC1(C2=CC=C(C=C2)Br)O)S(=O)(=O)C3=CC=CC4=C3C=CN=C4

InChI

InChI=1S/C20H19BrN2O3S/c21-17-6-4-16(5-7-17)20(24)9-12-23(13-10-20)27(25,26)19-3-1-2-15-14-22-11-8-18(15)19/h1-8,11,14,24H,9-10,12-13H2