1-cyclopropyl-6-fluoranyl-8-methoxy-7-(2-nitro-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-6-fluoranyl-8-methoxy-7-(2-nitro-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-6-fluoro-8-methoxy-7-(2-nitro-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-6-fluoro-8-methoxy-7-(2-nitro-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-6-fluoro-8-methoxy-7-(2-nitro-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-6-fluoro-4-keto-8-methoxy-7-(2-nitro-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)quinoline-3-carboxylic acid Formula: C21H18FN3O6S MolecularWeight: 459.447523

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=CC(=C1N3CCC4=C(C3)C=C(S4)[N+](=O)[O-])F)C(=O)C(=CN2C5CC5)C(=O)O

Isomeric SMILES

COC1=C2C(=CC(=C1N3CCC4=C(C3)C=C(S4)[N+](=O)[O-])F)C(=O)C(=CN2C5CC5)C(=O)O

InChI

InChI=1S/C21H18FN3O6S/c1-31-20-17-12(19(26)13(21(27)28)9-24(17)11-2-3-11)7-14(22)18(20)23-5-4-15-10(8-23)6-16(32-15)25(29)30/h6-7,9,11H,2-5,8H2,1H3,(H,27,28)