1-[3-nitro-4,5-bis(oxidanyl)phenyl]-3-(1,3-thiazolidin-3-yl)propan-1-one

Systemtic Name: 1-[3-nitro-4,5-bis(oxidanyl)phenyl]-3-(1,3-thiazolidin-3-yl)propan-1-one Openeye Name: 1-(3,4-dihydroxy-5-nitro-phenyl)-3-thiazolidin-3-yl-propan-1-one CAS Name: 1-(3,4-dihydroxy-5-nitrophenyl)-3-(3-thiazolidinyl)-1-propanone IUPAC Name: 1-(3,4-dihydroxy-5-nitrophenyl)-3-(1,3-thiazolidin-3-yl)propan-1-one Traditional Name: 1-(3,4-dihydroxy-5-nitro-phenyl)-3-thiazolidin-3-yl-propan-1-one Formula: C12H14N2O5S MolecularWeight: 298.31496

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCN1CCC(=O)C2=CC(=C(C(=C2)O)O)[N+](=O)[O-]

Isomeric SMILES

C1CSCN1CCC(=O)C2=CC(=C(C(=C2)O)O)[N+](=O)[O-]

InChI

InChI=1S/C12H14N2O5S/c15-10(1-2-13-3-4-20-7-13)8-5-9(14(18)19)12(17)11(16)6-8/h5-6,16-17H,1-4,7H2