2-(6-nitroquinolin-2-yl)sulfanylethanoic acid

Systemtic Name: 2-(6-nitroquinolin-2-yl)sulfanylethanoic acid Openeye Name: 2-[(6-nitro-2-quinolyl)sulfanyl]acetic acid CAS Name: 2-[(6-nitro-2-quinolinyl)thio]acetic acid IUPAC Name: 2-(6-nitroquinolin-2-yl)sulfanylacetic acid Traditional Name: 2-[(6-nitro-2-quinolyl)thio]acetic acid Formula: C11H8N2O4S MolecularWeight: 264.25722

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC(=N2)SCC(=O)O)C=C1[N+](=O)[O-]

Isomeric SMILES

C1=CC2=C(C=CC(=N2)SCC(=O)O)C=C1[N+](=O)[O-]

InChI

InChI=1S/C11H8N2O4S/c14-11(15)6-18-10-4-1-7-5-8(13(16)17)2-3-9(7)12-10/h1-5H,6H2,(H,14,15)