7-(1-azanyl-3H-isoindol-5-yl)-1-cyclopropyl-6-fluoranyl-8-methoxy-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-(1-azanyl-3H-isoindol-5-yl)-1-cyclopropyl-6-fluoranyl-8-methoxy-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-(1-amino-3H-isoindol-5-yl)-1-cyclopropyl-6-fluoro-8-methoxy-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-(1-amino-3H-isoindol-5-yl)-1-cyclopropyl-6-fluoro-8-methoxy-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-(1-amino-3H-isoindol-5-yl)-1-cyclopropyl-6-fluoro-8-methoxy-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-(1-amino-3H-isoindol-5-yl)-1-cyclopropyl-6-fluoro-4-keto-8-methoxy-quinoline-3-carboxylic acid Formula: C22H18FN3O4 MolecularWeight: 407.394423

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=CC(=C1C3=CC4=C(C=C3)C(=NC4)N)F)C(=O)C(=CN2C5CC5)C(=O)O

Isomeric SMILES

COC1=C2C(=CC(=C1C3=CC4=C(C=C3)C(=NC4)N)F)C(=O)C(=CN2C5CC5)C(=O)O

InChI

InChI=1S/C22H18FN3O4/c1-30-20-17(10-2-5-13-11(6-10)8-25-21(13)24)16(23)7-14-18(20)26(12-3-4-12)9-15(19(14)27)22(28)29/h2,5-7,9,12H,3-4,8H2,1H3,(H2,24,25)(H,28,29)