7-[3-(aminomethyl)phenyl]-1-cyclopropyl-6,8-bis(fluoranyl)-4-oxidanylidene-2-pyrrolidin-1-yl-quinoline-3-carboxylic acid

Systemtic Name: 7-[3-(aminomethyl)phenyl]-1-cyclopropyl-6,8-bis(fluoranyl)-4-oxidanylidene-2-pyrrolidin-1-yl-quinoline-3-carboxylic acid Openeye Name: 7-[3-(aminomethyl)phenyl]-1-cyclopropyl-6,8-difluoro-4-oxo-2-pyrrolidin-1-yl-quinoline-3-carboxylic acid CAS Name: 7-[3-(aminomethyl)phenyl]-1-cyclopropyl-6,8-difluoro-4-oxo-2-(1-pyrrolidinyl)-3-quinolinecarboxylic acid IUPAC Name: 7-[3-(aminomethyl)phenyl]-1-cyclopropyl-6,8-difluoro-4-oxo-2-pyrrolidin-1-ylquinoline-3-carboxylic acid Traditional Name: 7-[3-(aminomethyl)phenyl]-1-cyclopropyl-6,8-difluoro-4-keto-2-pyrrolidino-quinoline-3-carboxylic acid Formula: C24H23F2N3O3 MolecularWeight: 439.454526

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C(=O)C3=CC(=C(C(=C3N2C4CC4)F)C5=CC(=CC=C5)CN)F)C(=O)O

Isomeric SMILES

C1CCN(C1)C2=C(C(=O)C3=CC(=C(C(=C3N2C4CC4)F)C5=CC(=CC=C5)CN)F)C(=O)O

InChI

InChI=1S/C24H23F2N3O3/c25-17-11-16-21(20(26)18(17)14-5-3-4-13(10-14)12-27)29(15-6-7-15)23(28-8-1-2-9-28)19(22(16)30)24(31)32/h3-5,10-11,15H,1-2,6-9,12,27H2,(H,31,32)