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

Systemtic Name: 8-[(3S)-3-azanylpyrrolidin-1-yl]-7-fluoranyl-9-methyl-4-oxidanylidene-1-prop-1-en-2-yl-quinolizine-3-carboxylic acid Openeye Name: 8-[(3S)-3-aminopyrrolidin-1-yl]-7-fluoro-1-isopropenyl-9-methyl-4-oxo-quinolizine-3-carboxylic acid CAS Name: 8-[(3S)-3-amino-1-pyrrolidinyl]-7-fluoro-9-methyl-1-(1-methylethenyl)-4-oxo-3-quinolizinecarboxylic acid IUPAC Name: 8-[(3S)-3-aminopyrrolidin-1-yl]-7-fluoro-9-methyl-4-oxo-1-prop-1-en-2-ylquinolizine-3-carboxylic acid Traditional Name: 8-[(3S)-3-aminopyrrolidino]-7-fluoro-1-isopropenyl-4-keto-9-methyl-quinolizine-3-carboxylic acid Formula: C18H20FN3O3 MolecularWeight: 345.368103

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CN2C1=C(C=C(C2=O)C(=O)O)C(=C)C)F)N3CCC(C3)N

Isomeric SMILES

CC1=C(C(=CN2C1=C(C=C(C2=O)C(=O)O)C(=C)C)F)N3CC[C@@H](C3)N

InChI

InChI=1S/C18H20FN3O3/c1-9(2)12-6-13(18(24)25)17(23)22-8-14(19)16(10(3)15(12)22)21-5-4-11(20)7-21/h6,8,11H,1,4-5,7,20H2,2-3H3,(H,24,25)/t11-/m0/s1