7-[1-(3-azanylpyrrolidin-1-yl)cyclopropyl]-6-fluoranyl-4-oxidanylidene-1H-quinoline-3-carboxylic acid

Systemtic Name: 7-[1-(3-azanylpyrrolidin-1-yl)cyclopropyl]-6-fluoranyl-4-oxidanylidene-1H-quinoline-3-carboxylic acid Openeye Name: 7-[1-(3-aminopyrrolidin-1-yl)cyclopropyl]-6-fluoro-4-oxo-1H-quinoline-3-carboxylic acid CAS Name: 7-[1-(3-amino-1-pyrrolidinyl)cyclopropyl]-6-fluoro-4-oxo-1H-quinoline-3-carboxylic acid IUPAC Name: 7-[1-(3-aminopyrrolidin-1-yl)cyclopropyl]-6-fluoro-4-oxo-1H-quinoline-3-carboxylic acid Traditional Name: 7-[1-(3-aminopyrrolidino)cyclopropyl]-6-fluoro-4-keto-1H-quinoline-3-carboxylic acid Formula: C17H18FN3O3 MolecularWeight: 331.341523

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1N)C2(CC2)C3=C(C=C4C(=C3)NC=C(C4=O)C(=O)O)F

Isomeric SMILES

C1CN(CC1N)C2(CC2)C3=C(C=C4C(=C3)NC=C(C4=O)C(=O)O)F

InChI

InChI=1S/C17H18FN3O3/c18-13-5-10-14(20-7-11(15(10)22)16(23)24)6-12(13)17(2-3-17)21-4-1-9(19)8-21/h5-7,9H,1-4,8,19H2,(H,20,22)(H,23,24)