8-chloranyl-1-cyclopropyl-7-[3-(ethylamino)-4-methylsulfanyl-pyrrolidin-1-yl]-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 8-chloranyl-1-cyclopropyl-7-[3-(ethylamino)-4-methylsulfanyl-pyrrolidin-1-yl]-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 8-chloro-1-cyclopropyl-7-[3-(ethylamino)-4-methylsulfanyl-pyrrolidin-1-yl]-6-fluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 8-chloro-1-cyclopropyl-7-[3-(ethylamino)-4-(methylthio)-1-pyrrolidinyl]-6-fluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 8-chloro-1-cyclopropyl-7-[3-(ethylamino)-4-methylsulfanylpyrrolidin-1-yl]-6-fluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 8-chloro-1-cyclopropyl-7-[3-(ethylamino)-4-(methylthio)pyrrolidino]-6-fluoro-4-keto-quinoline-3-carboxylic acid Formula: C20H23ClFN3O3S MolecularWeight: 439.931323

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNC1CN(CC1SC)C2=C(C=C3C(=C2Cl)N(C=C(C3=O)C(=O)O)C4CC4)F

Isomeric SMILES

CCNC1CN(CC1SC)C2=C(C=C3C(=C2Cl)N(C=C(C3=O)C(=O)O)C4CC4)F

InChI

InChI=1S/C20H23ClFN3O3S/c1-3-23-14-8-24(9-15(14)29-2)18-13(22)6-11-17(16(18)21)25(10-4-5-10)7-12(19(11)26)20(27)28/h6-7,10,14-15,23H,3-5,8-9H2,1-2H3,(H,27,28)