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

Systemtic Name: 5-azanyl-1-cyclopropyl-6,8-bis(fluoranyl)-7-[3-[4-(methylaminomethyl)phenyl]pyrrolidin-1-yl]-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 5-amino-1-cyclopropyl-6,8-difluoro-7-[3-[4-(methylaminomethyl)phenyl]pyrrolidin-1-yl]-4-oxo-quinoline-3-carboxylic acid CAS Name: 5-amino-1-cyclopropyl-6,8-difluoro-7-[3-[4-(methylaminomethyl)phenyl]-1-pyrrolidinyl]-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 5-amino-1-cyclopropyl-6,8-difluoro-7-[3-[4-(methylaminomethyl)phenyl]pyrrolidin-1-yl]-4-oxoquinoline-3-carboxylic acid Traditional Name: 5-amino-1-cyclopropyl-6,8-difluoro-4-keto-7-[3-[4-(methylaminomethyl)phenyl]pyrrolidino]quinoline-3-carboxylic acid Formula: C25H26F2N4O3 MolecularWeight: 468.495746

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Descriptors Computed from Structure

Canonical SMILES:

CNCC1=CC=C(C=C1)C2CCN(C2)C3=C(C4=C(C(=C3F)N)C(=O)C(=CN4C5CC5)C(=O)O)F

Isomeric SMILES

CNCC1=CC=C(C=C1)C2CCN(C2)C3=C(C4=C(C(=C3F)N)C(=O)C(=CN4C5CC5)C(=O)O)F

InChI

InChI=1S/C25H26F2N4O3/c1-29-10-13-2-4-14(5-3-13)15-8-9-30(11-15)23-19(26)21(28)18-22(20(23)27)31(16-6-7-16)12-17(24(18)32)25(33)34/h2-5,12,15-16,29H,6-11,28H2,1H3,(H,33,34)