1-ethyl-6-fluoranyl-7-[2-[(2-hydroxyethylamino)methyl]-1,3-thiazol-4-yl]-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-ethyl-6-fluoranyl-7-[2-[(2-hydroxyethylamino)methyl]-1,3-thiazol-4-yl]-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-ethyl-6-fluoro-7-[2-[(2-hydroxyethylamino)methyl]thiazol-4-yl]-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-ethyl-6-fluoro-7-[2-[(2-hydroxyethylamino)methyl]-4-thiazolyl]-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-ethyl-6-fluoro-7-[2-[(2-hydroxyethylamino)methyl]-1,3-thiazol-4-yl]-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-ethyl-6-fluoro-7-[2-[(2-hydroxyethylamino)methyl]thiazol-4-yl]-4-keto-quinoline-3-carboxylic acid Formula: C18H18FN3O4S MolecularWeight: 391.416623

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C=C21)C3=CSC(=N3)CNCCO)F)C(=O)O

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C=C21)C3=CSC(=N3)CNCCO)F)C(=O)O

InChI

InChI=1S/C18H18FN3O4S/c1-2-22-8-12(18(25)26)17(24)11-5-13(19)10(6-15(11)22)14-9-27-16(21-14)7-20-3-4-23/h5-6,8-9,20,23H,2-4,7H2,1H3,(H,25,26)