2-[5-iodanyl-2-[3-(phenylmethyl)piperazin-1-yl]phenyl]phenol

Systemtic Name: 2-[5-iodanyl-2-[3-(phenylmethyl)piperazin-1-yl]phenyl]phenol Openeye Name: 2-[2-(3-benzylpiperazin-1-yl)-5-iodo-phenyl]phenol CAS Name: 2-[5-iodo-2-[3-(phenylmethyl)-1-piperazinyl]phenyl]phenol IUPAC Name: 2-[2-(3-benzylpiperazin-1-yl)-5-iodophenyl]phenol Traditional Name: 2-[2-(3-benzylpiperazino)-5-iodo-phenyl]phenol Formula: C23H23IN2O MolecularWeight: 470.34599

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(N1)CC2=CC=CC=C2)C3=C(C=C(C=C3)I)C4=CC=CC=C4O

Isomeric SMILES

C1CN(CC(N1)CC2=CC=CC=C2)C3=C(C=C(C=C3)I)C4=CC=CC=C4O

InChI

InChI=1S/C23H23IN2O/c24-18-10-11-22(21(15-18)20-8-4-5-9-23(20)27)26-13-12-25-19(16-26)14-17-6-2-1-3-7-17/h1-11,15,19,25,27H,12-14,16H2