2-[(7-nitro-2-oxidanylidene-3,4-dihydro-1H-quinolin-6-yl)sulfanyl]ethanoic acid

Systemtic Name: 2-[(7-nitro-2-oxidanylidene-3,4-dihydro-1H-quinolin-6-yl)sulfanyl]ethanoic acid Openeye Name: 2-[(7-nitro-2-oxo-3,4-dihydro-1H-quinolin-6-yl)sulfanyl]acetic acid CAS Name: 2-[(7-nitro-2-oxo-3,4-dihydro-1H-quinolin-6-yl)thio]acetic acid IUPAC Name: 2-[(7-nitro-2-oxo-3,4-dihydro-1H-quinolin-6-yl)sulfanyl]acetic acid Traditional Name: 2-[(2-keto-7-nitro-3,4-dihydro-1H-quinolin-6-yl)thio]acetic acid Formula: C11H10N2O5S MolecularWeight: 282.2725

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)NC2=CC(=C(C=C21)SCC(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1CC(=O)NC2=CC(=C(C=C21)SCC(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C11H10N2O5S/c14-10-2-1-6-3-9(19-5-11(15)16)8(13(17)18)4-7(6)12-10/h3-4H,1-2,5H2,(H,12,14)(H,15,16)