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

Systemtic Name: 2-[4-[2-(2-hydroxyphenyl)-4-propan-2-ylsulfonyl-phenyl]piperazin-2-yl]phenol Openeye Name: 2-[4-[2-(2-hydroxyphenyl)-4-isopropylsulfonyl-phenyl]piperazin-2-yl]phenol CAS Name: 2-[4-[2-(2-hydroxyphenyl)-4-propan-2-ylsulfonylphenyl]-2-piperazinyl]phenol IUPAC Name: 2-[4-[2-(2-hydroxyphenyl)-4-propan-2-ylsulfonylphenyl]piperazin-2-yl]phenol Traditional Name: 2-[4-[2-(2-hydroxyphenyl)-4-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=CC(=C(C=C1)N2CCNC(C2)C3=CC=CC=C3O)C4=CC=CC=C4O

Isomeric SMILES

CC(C)S(=O)(=O)C1=CC(=C(C=C1)N2CCNC(C2)C3=CC=CC=C3O)C4=CC=CC=C4O

InChI

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