7-[(8S)-7-azanyl-8-methyl-5-azaspiro[2.5]octan-5-yl]-1-cyclopropyl-6-fluoranyl-8-methoxy-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-[(8S)-7-azanyl-8-methyl-5-azaspiro[2.5]octan-5-yl]-1-cyclopropyl-6-fluoranyl-8-methoxy-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-[(8S)-7-amino-8-methyl-5-azaspiro[2.5]octan-5-yl]-1-cyclopropyl-6-fluoro-8-methoxy-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-[(8S)-7-amino-8-methyl-5-azaspiro[2.5]octan-5-yl]-1-cyclopropyl-6-fluoro-8-methoxy-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-[(8S)-7-amino-8-methyl-5-azaspiro[2.5]octan-5-yl]-1-cyclopropyl-6-fluoro-8-methoxy-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-[(8S)-7-amino-8-methyl-5-azaspiro[2.5]octan-5-yl]-1-cyclopropyl-6-fluoro-4-keto-8-methoxy-quinoline-3-carboxylic acid Formula: C22H26FN3O4 MolecularWeight: 415.457943

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(CN(CC12CC2)C3=C(C=C4C(=C3OC)N(C=C(C4=O)C(=O)O)C5CC5)F)N

Isomeric SMILES

C[C@@H]1C(CN(CC12CC2)C3=C(C=C4C(=C3OC)N(C=C(C4=O)C(=O)O)C5CC5)F)N

InChI

InChI=1S/C22H26FN3O4/c1-11-16(24)9-25(10-22(11)5-6-22)18-15(23)7-13-17(20(18)30-2)26(12-3-4-12)8-14(19(13)27)21(28)29/h7-8,11-12,16H,3-6,9-10,24H2,1-2H3,(H,28,29)/t11-,16?/m1/s1