[4-iodanyl-5-(4-methylpiperazin-1-yl)-2-nitro-phenyl]carbamic acid

Systemtic Name: [4-iodanyl-5-(4-methylpiperazin-1-yl)-2-nitro-phenyl]carbamic acid Openeye Name: [4-iodo-5-(4-methylpiperazin-1-yl)-2-nitro-phenyl]carbamic acid CAS Name: [4-iodo-5-(4-methyl-1-piperazinyl)-2-nitrophenyl]carbamic acid IUPAC Name: [4-iodo-5-(4-methylpiperazin-1-yl)-2-nitrophenyl]carbamic acid Traditional Name: [4-iodo-5-(4-methylpiperazino)-2-nitro-phenyl]carbamic acid Formula: C12H15IN4O4 MolecularWeight: 406.17637

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC(=C(C=C2I)[N+](=O)[O-])NC(=O)O

Isomeric SMILES

CN1CCN(CC1)C2=CC(=C(C=C2I)[N+](=O)[O-])NC(=O)O

InChI

InChI=1S/C12H15IN4O4/c1-15-2-4-16(5-3-15)10-7-9(14-12(18)19)11(17(20)21)6-8(10)13/h6-7,14H,2-5H2,1H3,(H,18,19)