(2-methanoyl-4-nitro-phenyl) 2-[2,4-bis(oxidanylidene)-1,3-thiazolidin-5-yl]ethanoate

Systemtic Name: (2-methanoyl-4-nitro-phenyl) 2-[2,4-bis(oxidanylidene)-1,3-thiazolidin-5-yl]ethanoate Openeye Name: (2-formyl-4-nitro-phenyl) 2-(2,4-dioxothiazolidin-5-yl)acetate CAS Name: 2-(2,4-dioxo-5-thiazolidinyl)acetic acid (2-formyl-4-nitrophenyl) ester IUPAC Name: (2-formyl-4-nitrophenyl) 2-(2,4-dioxo-1,3-thiazolidin-5-yl)acetate Traditional Name: 2-(2,4-diketothiazolidin-5-yl)acetic acid (2-formyl-4-nitro-phenyl) ester Formula: C12H8N2O7S MolecularWeight: 324.26612

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])C=O)OC(=O)CC2C(=O)NC(=O)S2

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])C=O)OC(=O)CC2C(=O)NC(=O)S2

InChI

InChI=1S/C12H8N2O7S/c15-5-6-3-7(14(19)20)1-2-8(6)21-10(16)4-9-11(17)13-12(18)22-9/h1-3,5,9H,4H2,(H,13,17,18)