2-nitro-6-[(4-phenyl-1,3-thiazol-2-yl)carbamoyl]benzoic acid

Systemtic Name: 2-nitro-6-[(4-phenyl-1,3-thiazol-2-yl)carbamoyl]benzoic acid Openeye Name: 2-nitro-6-[(4-phenylthiazol-2-yl)carbamoyl]benzoic acid CAS Name: 2-nitro-6-[oxo-[(4-phenyl-2-thiazolyl)amino]methyl]benzoic acid IUPAC Name: 2-nitro-6-[(4-phenyl-1,3-thiazol-2-yl)carbamoyl]benzoic acid Traditional Name: 2-nitro-6-[(4-phenylthiazol-2-yl)carbamoyl]benzoic acid Formula: C17H11N3O5S MolecularWeight: 369.35134

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=C(C(=CC=C3)[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=C(C(=CC=C3)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C17H11N3O5S/c21-15(11-7-4-8-13(20(24)25)14(11)16(22)23)19-17-18-12(9-26-17)10-5-2-1-3-6-10/h1-9H,(H,22,23)(H,18,19,21)