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

Systemtic Name: 7-(3-azanylpyrrolidin-1-yl)-1-cyclopropyl-6,8-bis(fluoranyl)-4H-quinoline-3-carboxylic acid Openeye Name: 7-(3-aminopyrrolidin-1-yl)-1-cyclopropyl-6,8-difluoro-4H-quinoline-3-carboxylic acid CAS Name: 7-(3-amino-1-pyrrolidinyl)-1-cyclopropyl-6,8-difluoro-4H-quinoline-3-carboxylic acid IUPAC Name: 7-(3-aminopyrrolidin-1-yl)-1-cyclopropyl-6,8-difluoro-4H-quinoline-3-carboxylic acid Traditional Name: 7-(3-aminopyrrolidino)-1-cyclopropyl-6,8-difluoro-4H-quinoline-3-carboxylic acid Formula: C17H19F2N3O2 MolecularWeight: 335.348466

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C=C(CC3=CC(=C(C(=C32)F)N4CCC(C4)N)F)C(=O)O

Isomeric SMILES

C1CC1N2C=C(CC3=CC(=C(C(=C32)F)N4CCC(C4)N)F)C(=O)O

InChI

InChI=1S/C17H19F2N3O2/c18-13-6-9-5-10(17(23)24)7-22(12-1-2-12)15(9)14(19)16(13)21-4-3-11(20)8-21/h6-7,11-12H,1-5,8,20H2,(H,23,24)