2-[[2-(3-iodanylpiperazin-1-yl)-2-[4-(2-methylpropyl)phenyl]ethyl]amino]phenol

Systemtic Name: 2-[[2-(3-iodanylpiperazin-1-yl)-2-[4-(2-methylpropyl)phenyl]ethyl]amino]phenol Openeye Name: 2-[[2-(3-iodopiperazin-1-yl)-2-(4-isobutylphenyl)ethyl]amino]phenol CAS Name: 2-[[2-(3-iodo-1-piperazinyl)-2-[4-(2-methylpropyl)phenyl]ethyl]amino]phenol IUPAC Name: 2-[[2-(3-iodopiperazin-1-yl)-2-[4-(2-methylpropyl)phenyl]ethyl]amino]phenol Traditional Name: 2-[[2-(3-iodopiperazino)-2-(4-isobutylphenyl)ethyl]amino]phenol Formula: C22H30IN3O MolecularWeight: 479.39757

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC=C(C=C1)C(CNC2=CC=CC=C2O)N3CCNC(C3)I

Isomeric SMILES

CC(C)CC1=CC=C(C=C1)C(CNC2=CC=CC=C2O)N3CCNC(C3)I

InChI

InChI=1S/C22H30IN3O/c1-16(2)13-17-7-9-18(10-8-17)20(26-12-11-24-22(23)15-26)14-25-19-5-3-4-6-21(19)27/h3-10,16,20,22,24-25,27H,11-15H2,1-2H3