3-iodanyl-1-(4-propan-2-ylsulfonyl-2-propyl-phenyl)piperazine

Systemtic Name: 3-iodanyl-1-(4-propan-2-ylsulfonyl-2-propyl-phenyl)piperazine Openeye Name: 3-iodo-1-(4-isopropylsulfonyl-2-propyl-phenyl)piperazine CAS Name: 3-iodo-1-(4-propan-2-ylsulfonyl-2-propylphenyl)piperazine IUPAC Name: 3-iodo-1-(4-propan-2-ylsulfonyl-2-propylphenyl)piperazine Traditional Name: 3-iodo-1-(4-isopropylsulfonyl-2-propyl-phenyl)piperazine Formula: C16H25IN2O2S MolecularWeight: 436.35137

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1)S(=O)(=O)C(C)C)N2CCNC(C2)I

Isomeric SMILES

CCCC1=C(C=CC(=C1)S(=O)(=O)C(C)C)N2CCNC(C2)I

InChI

InChI=1S/C16H25IN2O2S/c1-4-5-13-10-14(22(20,21)12(2)3)6-7-15(13)19-9-8-18-16(17)11-19/h6-7,10,12,16,18H,4-5,8-9,11H2,1-3H3