2-[(4-nitrophenyl)carbonylamino]-1,3-benzothiazole-6-carboxylate

Systemtic Name: 2-[(4-nitrophenyl)carbonylamino]-1,3-benzothiazole-6-carboxylate Openeye Name: 2-[(4-nitrobenzoyl)amino]-1,3-benzothiazole-6-carboxylate CAS Name: 2-[[(4-nitrophenyl)-oxomethyl]amino]-1,3-benzothiazole-6-carboxylate IUPAC Name: 2-[(4-nitrobenzoyl)amino]-1,3-benzothiazole-6-carboxylate Traditional Name: 2-[(4-nitrobenzoyl)amino]-1,3-benzothiazole-6-carboxylate Formula: C15H8N3O5S- MolecularWeight: 342.30612

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NC2=NC3=C(S2)C=C(C=C3)C(=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)NC2=NC3=C(S2)C=C(C=C3)C(=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C15H9N3O5S/c19-13(8-1-4-10(5-2-8)18(22)23)17-15-16-11-6-3-9(14(20)21)7-12(11)24-15/h1-7H,(H,20,21)(H,16,17,19)/p-1