1-[[5-[3,5-bis(iodanyl)-2-methoxy-phenyl]-1H-pyrrol-2-yl]methyl]piperidine hydrochloride

Systemtic Name: 1-[[5-[3,5-bis(iodanyl)-2-methoxy-phenyl]-1H-pyrrol-2-yl]methyl]piperidine hydrochloride Openeye Name: 1-[[5-(3,5-diiodo-2-methoxy-phenyl)-1H-pyrrol-2-yl]methyl]piperidine hydrochloride CAS Name: 1-[[5-(3,5-diiodo-2-methoxyphenyl)-1H-pyrrol-2-yl]methyl]piperidine hydrochloride IUPAC Name: 1-[[5-(3,5-diiodo-2-methoxyphenyl)-1H-pyrrol-2-yl]methyl]piperidine hydrochloride Traditional Name: 1-[[5-(3,5-diiodo-2-methoxy-phenyl)-1H-pyrrol-2-yl]methyl]piperidine hydrochloride Formula: C17H21ClI2N2O MolecularWeight: 558.62338

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1C2=CC=C(N2)CN3CCCCC3)I)I.Cl

Isomeric SMILES

COC1=C(C=C(C=C1C2=CC=C(N2)CN3CCCCC3)I)I.Cl

InChI

InChI=1S/C17H20I2N2O.ClH/c1-22-17-14(9-12(18)10-15(17)19)16-6-5-13(20-16)11-21-7-3-2-4-8-21;/h5-6,9-10,20H,2-4,7-8,11H2,1H3;1H