7-(3-azanylpyrrolidin-1-yl)-1-ethenyl-6,8-bis(fluoranyl)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-(3-azanylpyrrolidin-1-yl)-1-ethenyl-6,8-bis(fluoranyl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-(3-aminopyrrolidin-1-yl)-6,8-difluoro-4-oxo-1-vinyl-quinoline-3-carboxylic acid CAS Name: 7-(3-amino-1-pyrrolidinyl)-1-ethenyl-6,8-difluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-(3-aminopyrrolidin-1-yl)-1-ethenyl-6,8-difluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-(3-aminopyrrolidino)-6,8-difluoro-4-keto-1-vinyl-quinoline-3-carboxylic acid Formula: C16H15F2N3O3 MolecularWeight: 335.305406

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Descriptors Computed from Structure

Canonical SMILES:

C=CN1C=C(C(=O)C2=CC(=C(C(=C21)F)N3CCC(C3)N)F)C(=O)O

Isomeric SMILES

C=CN1C=C(C(=O)C2=CC(=C(C(=C21)F)N3CCC(C3)N)F)C(=O)O

InChI

InChI=1S/C16H15F2N3O3/c1-2-20-7-10(16(23)24)15(22)9-5-11(17)14(12(18)13(9)20)21-4-3-8(19)6-21/h2,5,7-8H,1,3-4,6,19H2,(H,23,24)