2-(6-bromanyl-3-nitro-quinolin-4-yl)sulfanylethanoic acid

Systemtic Name: 2-(6-bromanyl-3-nitro-quinolin-4-yl)sulfanylethanoic acid Openeye Name: 2-[(6-bromo-3-nitro-4-quinolyl)sulfanyl]acetic acid CAS Name: 2-[(6-bromo-3-nitro-4-quinolinyl)thio]acetic acid IUPAC Name: 2-(6-bromo-3-nitroquinolin-4-yl)sulfanylacetic acid Traditional Name: 2-[(6-bromo-3-nitro-4-quinolyl)thio]acetic acid Formula: C11H7BrN2O4S MolecularWeight: 343.15328

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=NC=C(C(=C2C=C1Br)SCC(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC2=NC=C(C(=C2C=C1Br)SCC(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C11H7BrN2O4S/c12-6-1-2-8-7(3-6)11(19-5-10(15)16)9(4-13-8)14(17)18/h1-4H,5H2,(H,15,16)