[4-iodanyl-5-[methyl-[2-(oxan-2-yloxy)ethyl]amino]-2-nitro-phenyl]carbamic acid

Systemtic Name: [4-iodanyl-5-[methyl-[2-(oxan-2-yloxy)ethyl]amino]-2-nitro-phenyl]carbamic acid Openeye Name: [4-iodo-5-[methyl(2-tetrahydropyran-2-yloxyethyl)amino]-2-nitro-phenyl]carbamic acid CAS Name: [4-iodo-5-[methyl-[2-(2-oxanyloxy)ethyl]amino]-2-nitrophenyl]carbamic acid IUPAC Name: [4-iodo-5-[methyl-[2-(oxan-2-yloxy)ethyl]amino]-2-nitrophenyl]carbamic acid Traditional Name: [4-iodo-5-[methyl(2-tetrahydropyran-2-yloxyethyl)amino]-2-nitro-phenyl]carbamic acid Formula: C15H20IN3O6 MolecularWeight: 465.24027

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CCOC1CCCCO1)C2=C(C=C(C(=C2)NC(=O)O)[N+](=O)[O-])I

Isomeric SMILES

CN(CCOC1CCCCO1)C2=C(C=C(C(=C2)NC(=O)O)[N+](=O)[O-])I

InChI

InChI=1S/C15H20IN3O6/c1-18(5-7-25-14-4-2-3-6-24-14)12-9-11(17-15(20)21)13(19(22)23)8-10(12)16/h8-9,14,17H,2-7H2,1H3,(H,20,21)