[4-(furan-2-ylmethyl)piperazin-1-yl]-(3-iodanylphenyl)methanone

Systemtic Name: [4-(furan-2-ylmethyl)piperazin-1-yl]-(3-iodanylphenyl)methanone Openeye Name: [4-(2-furylmethyl)piperazin-1-yl]-(3-iodophenyl)methanone CAS Name: [4-(2-furanylmethyl)-1-piperazinyl]-(3-iodophenyl)methanone IUPAC Name: [4-(furan-2-ylmethyl)piperazin-1-yl]-(3-iodophenyl)methanone Traditional Name: [4-(2-furfuryl)piperazino]-(3-iodophenyl)methanone Formula: C16H17IN2O2 MolecularWeight: 396.22285

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CO2)C(=O)C3=CC(=CC=C3)I

Isomeric SMILES

C1CN(CCN1CC2=CC=CO2)C(=O)C3=CC(=CC=C3)I

InChI

InChI=1S/C16H17IN2O2/c17-14-4-1-3-13(11-14)16(20)19-8-6-18(7-9-19)12-15-5-2-10-21-15/h1-5,10-11H,6-9,12H2