8-[(3S)-3-azanylpyrrolidin-1-yl]-7-fluoranyl-1,9-dimethyl-4-oxidanylidene-quinolizine-3-carboxylic acid

Systemtic Name: 8-[(3S)-3-azanylpyrrolidin-1-yl]-7-fluoranyl-1,9-dimethyl-4-oxidanylidene-quinolizine-3-carboxylic acid Openeye Name: 8-[(3S)-3-aminopyrrolidin-1-yl]-7-fluoro-1,9-dimethyl-4-oxo-quinolizine-3-carboxylic acid CAS Name: 8-[(3S)-3-amino-1-pyrrolidinyl]-7-fluoro-1,9-dimethyl-4-oxo-3-quinolizinecarboxylic acid IUPAC Name: 8-[(3S)-3-aminopyrrolidin-1-yl]-7-fluoro-1,9-dimethyl-4-oxoquinolizine-3-carboxylic acid Traditional Name: 8-[(3S)-3-aminopyrrolidino]-7-fluoro-4-keto-1,9-dimethyl-quinolizine-3-carboxylic acid Formula: C16H18FN3O3 MolecularWeight: 319.330823

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C(=CN2C(=O)C(=C1)C(=O)O)F)N3CCC(C3)N)C

Isomeric SMILES

CC1=C2C(=C(C(=CN2C(=O)C(=C1)C(=O)O)F)N3CC[C@@H](C3)N)C

InChI

InChI=1S/C16H18FN3O3/c1-8-5-11(16(22)23)15(21)20-7-12(17)14(9(2)13(8)20)19-4-3-10(18)6-19/h5,7,10H,3-4,6,18H2,1-2H3,(H,22,23)/t10-/m0/s1