7-(4-azanyl-7-methyl-1,3,3a,4,7,7a-hexahydroisoindol-2-yl)-1-cyclopropyl-8-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-(4-azanyl-7-methyl-1,3,3a,4,7,7a-hexahydroisoindol-2-yl)-1-cyclopropyl-8-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-(4-amino-7-methyl-1,3,3a,4,7,7a-hexahydroisoindol-2-yl)-1-cyclopropyl-8-fluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-(4-amino-7-methyl-1,3,3a,4,7,7a-hexahydroisoindol-2-yl)-1-cyclopropyl-8-fluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-(4-amino-7-methyl-1,3,3a,4,7,7a-hexahydroisoindol-2-yl)-1-cyclopropyl-8-fluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-(4-amino-7-methyl-1,3,3a,4,7,7a-hexahydroisoindol-2-yl)-1-cyclopropyl-8-fluoro-4-keto-quinoline-3-carboxylic acid Formula: C22H24FN3O3 MolecularWeight: 397.442663

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Descriptors Computed from Structure

Canonical SMILES:

CC1C=CC(C2C1CN(C2)C3=C(C4=C(C=C3)C(=O)C(=CN4C5CC5)C(=O)O)F)N

Isomeric SMILES

CC1C=CC(C2C1CN(C2)C3=C(C4=C(C=C3)C(=O)C(=CN4C5CC5)C(=O)O)F)N

InChI

InChI=1S/C22H24FN3O3/c1-11-2-6-17(24)15-9-25(8-14(11)15)18-7-5-13-20(19(18)23)26(12-3-4-12)10-16(21(13)27)22(28)29/h2,5-7,10-12,14-15,17H,3-4,8-9,24H2,1H3,(H,28,29)