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

Systemtic Name: 4-(4-bromophenyl)-1-(4-butylphenyl)sulfonyl-piperidin-4-ol Openeye Name: 4-(4-bromophenyl)-1-(4-butylphenyl)sulfonyl-piperidin-4-ol CAS Name: 4-(4-bromophenyl)-1-(4-butylphenyl)sulfonyl-4-piperidinol IUPAC Name: 4-(4-bromophenyl)-1-(4-butylphenyl)sulfonylpiperidin-4-ol Traditional Name: 4-(4-bromophenyl)-1-(4-butylphenyl)sulfonyl-piperidin-4-ol Formula: C21H26BrNO3S MolecularWeight: 452.40504

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)(C3=CC=C(C=C3)Br)O

Isomeric SMILES

CCCCC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)(C3=CC=C(C=C3)Br)O

InChI

InChI=1S/C21H26BrNO3S/c1-2-3-4-17-5-11-20(12-6-17)27(25,26)23-15-13-21(24,14-16-23)18-7-9-19(22)10-8-18/h5-12,24H,2-4,13-16H2,1H3