8-[(3S)-3-azanylpyrrolidin-1-yl]-1-butan-2-yl-7-fluoranyl-9-methyl-4-oxidanylidene-quinolizine-3-carboxylic acid

Systemtic Name: 8-[(3S)-3-azanylpyrrolidin-1-yl]-1-butan-2-yl-7-fluoranyl-9-methyl-4-oxidanylidene-quinolizine-3-carboxylic acid Openeye Name: 8-[(3S)-3-aminopyrrolidin-1-yl]-7-fluoro-9-methyl-4-oxo-1-sec-butyl-quinolizine-3-carboxylic acid CAS Name: 8-[(3S)-3-amino-1-pyrrolidinyl]-1-butan-2-yl-7-fluoro-9-methyl-4-oxo-3-quinolizinecarboxylic acid IUPAC Name: 8-[(3S)-3-aminopyrrolidin-1-yl]-1-butan-2-yl-7-fluoro-9-methyl-4-oxoquinolizine-3-carboxylic acid Traditional Name: 8-[(3S)-3-aminopyrrolidino]-7-fluoro-4-keto-9-methyl-1-sec-butyl-quinolizine-3-carboxylic acid Formula: C19H24FN3O3 MolecularWeight: 361.410563

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=C2C(=C(C(=CN2C(=O)C(=C1)C(=O)O)F)N3CCC(C3)N)C

Isomeric SMILES

CCC(C)C1=C2C(=C(C(=CN2C(=O)C(=C1)C(=O)O)F)N3CC[C@@H](C3)N)C

InChI

InChI=1S/C19H24FN3O3/c1-4-10(2)13-7-14(19(25)26)18(24)23-9-15(20)17(11(3)16(13)23)22-6-5-12(21)8-22/h7,9-10,12H,4-6,8,21H2,1-3H3,(H,25,26)/t10?,12-/m0/s1