2-[2-[(5-nitro-1,3-thiazol-2-yl)carbamoyl]phenyl]ethanoic acid

Systemtic Name: 2-[2-[(5-nitro-1,3-thiazol-2-yl)carbamoyl]phenyl]ethanoic acid Openeye Name: 2-[2-[(5-nitrothiazol-2-yl)carbamoyl]phenyl]acetic acid CAS Name: 2-[2-[[(5-nitro-2-thiazolyl)amino]-oxomethyl]phenyl]acetic acid IUPAC Name: 2-[2-[(5-nitro-1,3-thiazol-2-yl)carbamoyl]phenyl]acetic acid Traditional Name: 2-[2-[(5-nitrothiazol-2-yl)carbamoyl]phenyl]acetic acid Formula: C12H9N3O5S MolecularWeight: 307.28196

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H9N3O5S/c16-10(17)5-7-3-1-2-4-8(7)11(18)14-12-13-6-9(21-12)15(19)20/h1-4,6H,5H2,(H,16,17)(H,13,14,18)