2-[[(3R)-1,1-bis(oxidanylidene)-2,3-dihydrothiophen-3-yl]iminomethyl]-4-chloranyl-6-nitro-phenolate

Systemtic Name: 2-[[(3R)-1,1-bis(oxidanylidene)-2,3-dihydrothiophen-3-yl]iminomethyl]-4-chloranyl-6-nitro-phenolate Openeye Name: 4-chloro-2-[[(3R)-1,1-dioxo-2,3-dihydrothiophen-3-yl]iminomethyl]-6-nitro-phenolate CAS Name: 4-chloro-2-[[(3R)-1,1-dioxo-2,3-dihydrothiophen-3-yl]iminomethyl]-6-nitrophenolate IUPAC Name: 4-chloro-2-[[(3R)-1,1-dioxo-2,3-dihydrothiophen-3-yl]iminomethyl]-6-nitrophenolate Traditional Name: 4-chloro-2-[[(3R)-1,1-diketo-2,3-dihydrothiophen-3-yl]iminomethyl]-6-nitro-phenolate Formula: C11H8ClN2O5S- MolecularWeight: 315.70962

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(C=CS1(=O)=O)N=CC2=CC(=CC(=C2[O-])[N+](=O)[O-])Cl

Isomeric SMILES

C1[C@@H](C=CS1(=O)=O)N=CC2=CC(=CC(=C2[O-])[N+](=O)[O-])Cl

InChI

InChI=1S/C11H9ClN2O5S/c12-8-3-7(11(15)10(4-8)14(16)17)5-13-9-1-2-20(18,19)6-9/h1-5,9,15H,6H2/p-1/t9-/m1/s1