3-[3-(1-azanylethyl)pyrrolidin-1-yl]-1-[2,4-bis(fluoranyl)phenyl]-6-fluoranyl-5-methyl-4-oxidanylidene-1,8-naphthyridine-2-carboxylic acid

Systemtic Name: 3-[3-(1-azanylethyl)pyrrolidin-1-yl]-1-[2,4-bis(fluoranyl)phenyl]-6-fluoranyl-5-methyl-4-oxidanylidene-1,8-naphthyridine-2-carboxylic acid Openeye Name: 3-[3-(1-aminoethyl)pyrrolidin-1-yl]-1-(2,4-difluorophenyl)-6-fluoro-5-methyl-4-oxo-1,8-naphthyridine-2-carboxylic acid CAS Name: 3-[3-(1-aminoethyl)-1-pyrrolidinyl]-1-(2,4-difluorophenyl)-6-fluoro-5-methyl-4-oxo-1,8-naphthyridine-2-carboxylic acid IUPAC Name: 3-[3-(1-aminoethyl)pyrrolidin-1-yl]-1-(2,4-difluorophenyl)-6-fluoro-5-methyl-4-oxo-1,8-naphthyridine-2-carboxylic acid Traditional Name: 3-[3-(1-aminoethyl)pyrrolidino]-1-(2,4-difluorophenyl)-6-fluoro-4-keto-5-methyl-1,8-naphthyridine-2-carboxylic acid Formula: C22H21F3N4O3 MolecularWeight: 446.42235

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=O)C(=C(N(C2=NC=C1F)C3=C(C=C(C=C3)F)F)C(=O)O)N4CCC(C4)C(C)N

Isomeric SMILES

CC1=C2C(=O)C(=C(N(C2=NC=C1F)C3=C(C=C(C=C3)F)F)C(=O)O)N4CCC(C4)C(C)N

InChI

InChI=1S/C22H21F3N4O3/c1-10-15(25)8-27-21-17(10)20(30)18(28-6-5-12(9-28)11(2)26)19(22(31)32)29(21)16-4-3-13(23)7-14(16)24/h3-4,7-8,11-12H,5-6,9,26H2,1-2H3,(H,31,32)