1-ethyl-7-[2-(ethylaminomethyl)-1,3-thiazol-4-yl]-6,8-bis(fluoranyl)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-ethyl-7-[2-(ethylaminomethyl)-1,3-thiazol-4-yl]-6,8-bis(fluoranyl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-ethyl-7-[2-(ethylaminomethyl)thiazol-4-yl]-6,8-difluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-ethyl-7-[2-(ethylaminomethyl)-4-thiazolyl]-6,8-difluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-ethyl-7-[2-(ethylaminomethyl)-1,3-thiazol-4-yl]-6,8-difluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-ethyl-7-[2-(ethylaminomethyl)thiazol-4-yl]-6,8-difluoro-4-keto-quinoline-3-carboxylic acid Formula: C18H17F2N3O3S MolecularWeight: 393.407686

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNCC1=NC(=CS1)C2=C(C=C3C(=C2F)N(C=C(C3=O)C(=O)O)CC)F

Isomeric SMILES

CCNCC1=NC(=CS1)C2=C(C=C3C(=C2F)N(C=C(C3=O)C(=O)O)CC)F

InChI

InChI=1S/C18H17F2N3O3S/c1-3-21-6-13-22-12(8-27-13)14-11(19)5-9-16(15(14)20)23(4-2)7-10(17(9)24)18(25)26/h5,7-8,21H,3-4,6H2,1-2H3,(H,25,26)