methyl 3-nitro-5-(1,3-thiazol-2-ylcarbamoyl)benzoate

Systemtic Name: methyl 3-nitro-5-(1,3-thiazol-2-ylcarbamoyl)benzoate Openeye Name: methyl 3-nitro-5-(thiazol-2-ylcarbamoyl)benzoate CAS Name: 3-nitro-5-[oxo-(2-thiazolylamino)methyl]benzoic acid methyl ester IUPAC Name: methyl 3-nitro-5-(1,3-thiazol-2-ylcarbamoyl)benzoate Traditional Name: 3-nitro-5-(thiazol-2-ylcarbamoyl)benzoic acid methyl ester Formula: C12H9N3O5S MolecularWeight: 307.28196

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)C(=O)NC2=NC=CS2)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)C(=O)NC2=NC=CS2)[N+](=O)[O-]

InChI

InChI=1S/C12H9N3O5S/c1-20-11(17)8-4-7(5-9(6-8)15(18)19)10(16)14-12-13-2-3-21-12/h2-6H,1H3,(H,13,14,16)