[4-(2-hydroxyethyl)piperazin-1-yl]-(2-iodanyl-5-nitro-phenyl)methanone

Systemtic Name: [4-(2-hydroxyethyl)piperazin-1-yl]-(2-iodanyl-5-nitro-phenyl)methanone Openeye Name: [4-(2-hydroxyethyl)piperazin-1-yl]-(2-iodo-5-nitro-phenyl)methanone CAS Name: [4-(2-hydroxyethyl)-1-piperazinyl]-(2-iodo-5-nitrophenyl)methanone IUPAC Name: [4-(2-hydroxyethyl)piperazin-1-yl]-(2-iodo-5-nitrophenyl)methanone Traditional Name: [4-(2-hydroxyethyl)piperazino]-(2-iodo-5-nitro-phenyl)methanone Formula: C13H16IN3O4 MolecularWeight: 405.18831

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCO)C(=O)C2=C(C=CC(=C2)[N+](=O)[O-])I

Isomeric SMILES

C1CN(CCN1CCO)C(=O)C2=C(C=CC(=C2)[N+](=O)[O-])I

InChI

InChI=1S/C13H16IN3O4/c14-12-2-1-10(17(20)21)9-11(12)13(19)16-5-3-15(4-6-16)7-8-18/h1-2,9,18H,3-8H2