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

Systemtic Name: 5-azanyl-1-cyclopropyl-6,8-bis(fluoranyl)-7-[1-(iminomethyl)pyrrolidin-3-yl]oxy-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 5-amino-1-cyclopropyl-6,8-difluoro-7-(1-methanimidoylpyrrolidin-3-yl)oxy-4-oxo-quinoline-3-carboxylic acid CAS Name: 5-amino-1-cyclopropyl-6,8-difluoro-7-[(1-methanimidoyl-3-pyrrolidinyl)oxy]-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 5-amino-1-cyclopropyl-6,8-difluoro-7-(1-methanimidoylpyrrolidin-3-yl)oxy-4-oxoquinoline-3-carboxylic acid Traditional Name: 5-amino-1-cyclopropyl-6,8-difluoro-7-(1-formimidoylpyrrolidin-3-yl)oxy-4-keto-quinoline-3-carboxylic acid Formula: C18H18F2N4O4 MolecularWeight: 392.356726

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C=C(C(=O)C3=C2C(=C(C(=C3N)F)OC4CCN(C4)C=N)F)C(=O)O

Isomeric SMILES

C1CC1N2C=C(C(=O)C3=C2C(=C(C(=C3N)F)OC4CCN(C4)C=N)F)C(=O)O

InChI

InChI=1S/C18H18F2N4O4/c19-12-14(22)11-15(13(20)17(12)28-9-3-4-23(5-9)7-21)24(8-1-2-8)6-10(16(11)25)18(26)27/h6-9,21H,1-5,22H2,(H,26,27)