6-chloranyl-1-ethyl-7-(5-nitrofuran-2-yl)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 6-chloranyl-1-ethyl-7-(5-nitrofuran-2-yl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 6-chloro-1-ethyl-7-(5-nitro-2-furyl)-4-oxo-quinoline-3-carboxylic acid CAS Name: 6-chloro-1-ethyl-7-(5-nitro-2-furanyl)-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 6-chloro-1-ethyl-7-(5-nitrofuran-2-yl)-4-oxoquinoline-3-carboxylic acid Traditional Name: 6-chloro-1-ethyl-4-keto-7-(5-nitro-2-furyl)quinoline-3-carboxylic acid Formula: C16H11ClN2O6 MolecularWeight: 362.72134

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C=C21)C3=CC=C(O3)[N+](=O)[O-])Cl)C(=O)O

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C=C21)C3=CC=C(O3)[N+](=O)[O-])Cl)C(=O)O

InChI

InChI=1S/C16H11ClN2O6/c1-2-18-7-10(16(21)22)15(20)9-5-11(17)8(6-12(9)18)13-3-4-14(25-13)19(23)24/h3-7H,2H2,1H3,(H,21,22)