6-[2-[(4-nitrophenyl)amino]-4-oxidanylidene-1,3-thiazol-5-yl]hexanoic acid

Systemtic Name: 6-[2-[(4-nitrophenyl)amino]-4-oxidanylidene-1,3-thiazol-5-yl]hexanoic acid Openeye Name: 6-[2-(4-nitroanilino)-4-oxo-thiazol-5-yl]hexanoic acid CAS Name: 6-[2-(4-nitroanilino)-4-oxo-5-thiazolyl]hexanoic acid IUPAC Name: 6-[2-(4-nitroanilino)-4-oxo-1,3-thiazol-5-yl]hexanoic acid Traditional Name: 6-[4-keto-2-(4-nitroanilino)-2-thiazolin-5-yl]hexanoic acid Formula: C15H17N3O5S MolecularWeight: 351.37758

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC2=NC(=O)C(S2)CCCCCC(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1NC2=NC(=O)C(S2)CCCCCC(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C15H17N3O5S/c19-13(20)5-3-1-2-4-12-14(21)17-15(24-12)16-10-6-8-11(9-7-10)18(22)23/h6-9,12H,1-5H2,(H,19,20)(H,16,17,21)