4-(4-bromophenyl)-1-(4-pentylphenyl)sulfonyl-piperidin-4-ol

Systemtic Name: 4-(4-bromophenyl)-1-(4-pentylphenyl)sulfonyl-piperidin-4-ol Openeye Name: 4-(4-bromophenyl)-1-(4-pentylphenyl)sulfonyl-piperidin-4-ol CAS Name: 4-(4-bromophenyl)-1-(4-pentylphenyl)sulfonyl-4-piperidinol IUPAC Name: 4-(4-bromophenyl)-1-(4-pentylphenyl)sulfonylpiperidin-4-ol Traditional Name: 1-(4-amylphenyl)sulfonyl-4-(4-bromophenyl)piperidin-4-ol Formula: C22H28BrNO3S MolecularWeight: 466.43162

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)(C3=CC=C(C=C3)Br)O

Isomeric SMILES

CCCCCC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)(C3=CC=C(C=C3)Br)O

InChI

InChI=1S/C22H28BrNO3S/c1-2-3-4-5-18-6-12-21(13-7-18)28(26,27)24-16-14-22(25,15-17-24)19-8-10-20(23)11-9-19/h6-13,25H,2-5,14-17H2,1H3