2-[5-iodanyl-2-(3-propan-2-ylsulfonylpiperazin-1-yl)phenyl]phenol

Systemtic Name: 2-[5-iodanyl-2-(3-propan-2-ylsulfonylpiperazin-1-yl)phenyl]phenol Openeye Name: 2-[5-iodo-2-(3-isopropylsulfonylpiperazin-1-yl)phenyl]phenol CAS Name: 2-[5-iodo-2-(3-propan-2-ylsulfonyl-1-piperazinyl)phenyl]phenol IUPAC Name: 2-[5-iodo-2-(3-propan-2-ylsulfonylpiperazin-1-yl)phenyl]phenol Traditional Name: 2-[5-iodo-2-(3-isopropylsulfonylpiperazino)phenyl]phenol Formula: C19H23IN2O3S MolecularWeight: 486.36699

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)C1CN(CCN1)C2=C(C=C(C=C2)I)C3=CC=CC=C3O

Isomeric SMILES

CC(C)S(=O)(=O)C1CN(CCN1)C2=C(C=C(C=C2)I)C3=CC=CC=C3O

InChI

InChI=1S/C19H23IN2O3S/c1-13(2)26(24,25)19-12-22(10-9-21-19)17-8-7-14(20)11-16(17)15-5-3-4-6-18(15)23/h3-8,11,13,19,21,23H,9-10,12H2,1-2H3