5-azanyl-1-cyclopropyl-7-[3-ethyl-4-(methoxycarbonylamino)pyrrolidin-1-yl]-6,8-bis(fluoranyl)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 5-azanyl-1-cyclopropyl-7-[3-ethyl-4-(methoxycarbonylamino)pyrrolidin-1-yl]-6,8-bis(fluoranyl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 5-amino-1-cyclopropyl-7-[3-ethyl-4-(methoxycarbonylamino)pyrrolidin-1-yl]-6,8-difluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 5-amino-1-cyclopropyl-7-[3-ethyl-4-(methoxycarbonylamino)-1-pyrrolidinyl]-6,8-difluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 5-amino-1-cyclopropyl-7-[3-ethyl-4-(methoxycarbonylamino)pyrrolidin-1-yl]-6,8-difluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 5-amino-7-[3-(carbomethoxyamino)-4-ethyl-pyrrolidino]-1-cyclopropyl-6,8-difluoro-4-keto-quinoline-3-carboxylic acid Formula: C21H24F2N4O5 MolecularWeight: 450.435866

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1CN(CC1NC(=O)OC)C2=C(C3=C(C(=C2F)N)C(=O)C(=CN3C4CC4)C(=O)O)F

Isomeric SMILES

CCC1CN(CC1NC(=O)OC)C2=C(C3=C(C(=C2F)N)C(=O)C(=CN3C4CC4)C(=O)O)F

InChI

InChI=1S/C21H24F2N4O5/c1-3-9-6-26(8-12(9)25-21(31)32-2)18-14(22)16(24)13-17(15(18)23)27(10-4-5-10)7-11(19(13)28)20(29)30/h7,9-10,12H,3-6,8,24H2,1-2H3,(H,25,31)(H,29,30)