2-[2-(3-methoxypiperazin-1-yl)-5-propan-2-ylsulfonyl-phenyl]phenol

Systemtic Name: 2-[2-(3-methoxypiperazin-1-yl)-5-propan-2-ylsulfonyl-phenyl]phenol Openeye Name: 2-[5-isopropylsulfonyl-2-(3-methoxypiperazin-1-yl)phenyl]phenol CAS Name: 2-[2-(3-methoxy-1-piperazinyl)-5-propan-2-ylsulfonylphenyl]phenol IUPAC Name: 2-[2-(3-methoxypiperazin-1-yl)-5-propan-2-ylsulfonylphenyl]phenol Traditional Name: 2-[5-isopropylsulfonyl-2-(3-methoxypiperazino)phenyl]phenol Formula: C20H26N2O4S MolecularWeight: 390.49644

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H26N2O4S/c1-14(2)27(24,25)15-8-9-18(22-11-10-21-20(13-22)26-3)17(12-15)16-6-4-5-7-19(16)23/h4-9,12,14,20-21,23H,10-11,13H2,1-3H3