2-[(6-nitro-1,3-benzothiazol-2-yl)carbamoyl]benzoic acid

Systemtic Name: 2-[(6-nitro-1,3-benzothiazol-2-yl)carbamoyl]benzoic acid Openeye Name: 2-[(6-nitro-1,3-benzothiazol-2-yl)carbamoyl]benzoic acid CAS Name: 2-[[(6-nitro-1,3-benzothiazol-2-yl)amino]-oxomethyl]benzoic acid IUPAC Name: 2-[(6-nitro-1,3-benzothiazol-2-yl)carbamoyl]benzoic acid Traditional Name: 2-[(6-nitro-1,3-benzothiazol-2-yl)carbamoyl]benzoic acid Formula: C15H9N3O5S MolecularWeight: 343.31406

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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