2-[4-[4-(2-hydroxyphenyl)-2-propan-2-ylsulfonyl-phenyl]piperazin-2-yl]phenol

Systemtic Name: 2-[4-[4-(2-hydroxyphenyl)-2-propan-2-ylsulfonyl-phenyl]piperazin-2-yl]phenol Openeye Name: 2-[4-[4-(2-hydroxyphenyl)-2-isopropylsulfonyl-phenyl]piperazin-2-yl]phenol CAS Name: 2-[4-[4-(2-hydroxyphenyl)-2-propan-2-ylsulfonylphenyl]-2-piperazinyl]phenol IUPAC Name: 2-[4-[4-(2-hydroxyphenyl)-2-propan-2-ylsulfonylphenyl]piperazin-2-yl]phenol Traditional Name: 2-[4-[4-(2-hydroxyphenyl)-2-isopropylsulfonyl-phenyl]piperazin-2-yl]phenol Formula: C25H28N2O4S MolecularWeight: 452.56582

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)C1=C(C=CC(=C1)C2=CC=CC=C2O)N3CCNC(C3)C4=CC=CC=C4O

Isomeric SMILES

CC(C)S(=O)(=O)C1=C(C=CC(=C1)C2=CC=CC=C2O)N3CCNC(C3)C4=CC=CC=C4O

InChI

InChI=1S/C25H28N2O4S/c1-17(2)32(30,31)25-15-18(19-7-3-5-9-23(19)28)11-12-22(25)27-14-13-26-21(16-27)20-8-4-6-10-24(20)29/h3-12,15,17,21,26,28-29H,13-14,16H2,1-2H3