8-[(7S,8S)-7-azanyl-8-methyl-5-azaspiro[2.5]octan-5-yl]-1-cyclopropyl-7-fluoranyl-9-methyl-4-oxidanylidene-quinolizine-3-carboxylic acid

Systemtic Name: 8-[(7S,8S)-7-azanyl-8-methyl-5-azaspiro[2.5]octan-5-yl]-1-cyclopropyl-7-fluoranyl-9-methyl-4-oxidanylidene-quinolizine-3-carboxylic acid Openeye Name: 8-[(7S,8S)-7-amino-8-methyl-5-azaspiro[2.5]octan-5-yl]-1-cyclopropyl-7-fluoro-9-methyl-4-oxo-quinolizine-3-carboxylic acid CAS Name: 8-[(7S,8S)-7-amino-8-methyl-5-azaspiro[2.5]octan-5-yl]-1-cyclopropyl-7-fluoro-9-methyl-4-oxo-3-quinolizinecarboxylic acid IUPAC Name: 8-[(7S,8S)-7-amino-8-methyl-5-azaspiro[2.5]octan-5-yl]-1-cyclopropyl-7-fluoro-9-methyl-4-oxoquinolizine-3-carboxylic acid Traditional Name: 8-[(7S,8S)-7-amino-8-methyl-5-azaspiro[2.5]octan-5-yl]-1-cyclopropyl-7-fluoro-4-keto-9-methyl-quinolizine-3-carboxylic acid Formula: C22H26FN3O3 MolecularWeight: 399.458543

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(CN(CC12CC2)C3=C(C4=C(C=C(C(=O)N4C=C3F)C(=O)O)C5CC5)C)N

Isomeric SMILES

C[C@@H]1[C@@H](CN(CC12CC2)C3=C(C4=C(C=C(C(=O)N4C=C3F)C(=O)O)C5CC5)C)N

InChI

InChI=1S/C22H26FN3O3/c1-11-18-14(13-3-4-13)7-15(21(28)29)20(27)26(18)8-16(23)19(11)25-9-17(24)12(2)22(10-25)5-6-22/h7-8,12-13,17H,3-6,9-10,24H2,1-2H3,(H,28,29)/t12-,17-/m1/s1