2-[[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]amino]-5-nitro-benzoate

Systemtic Name: 2-[[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]amino]-5-nitro-benzoate Openeye Name: 2-[[(3S)-1,1-dioxothiolan-3-yl]amino]-5-nitro-benzoate CAS Name: 2-[[(3S)-1,1-dioxo-3-thiolanyl]amino]-5-nitrobenzoate IUPAC Name: 2-[[(3S)-1,1-dioxothiolan-3-yl]amino]-5-nitrobenzoate Traditional Name: 2-[[(3S)-1,1-diketothiolan-3-yl]amino]-5-nitro-benzoate Formula: C11H11N2O6S- MolecularWeight: 299.27984

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CC1NC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)[O-]

Isomeric SMILES

C1CS(=O)(=O)C[C@H]1NC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)[O-]

InChI

InChI=1S/C11H12N2O6S/c14-11(15)9-5-8(13(16)17)1-2-10(9)12-7-3-4-20(18,19)6-7/h1-2,5,7,12H,3-4,6H2,(H,14,15)/p-1/t7-/m0/s1