5-azanyl-1-cyclopropyl-6-fluoranyl-4-oxidanylidene-8-propan-2-yloxy-7-[2-(pyridin-2-ylamino)ethylamino]quinoline-3-carboxylic acid

Systemtic Name: 5-azanyl-1-cyclopropyl-6-fluoranyl-4-oxidanylidene-8-propan-2-yloxy-7-[2-(pyridin-2-ylamino)ethylamino]quinoline-3-carboxylic acid Openeye Name: 5-amino-1-cyclopropyl-6-fluoro-8-isopropoxy-4-oxo-7-[2-(2-pyridylamino)ethylamino]quinoline-3-carboxylic acid CAS Name: 5-amino-1-cyclopropyl-6-fluoro-4-oxo-8-propan-2-yloxy-7-[2-(2-pyridinylamino)ethylamino]-3-quinolinecarboxylic acid IUPAC Name: 5-amino-1-cyclopropyl-6-fluoro-4-oxo-8-propan-2-yloxy-7-[2-(pyridin-2-ylamino)ethylamino]quinoline-3-carboxylic acid Traditional Name: 5-amino-1-cyclopropyl-6-fluoro-8-isopropoxy-4-keto-7-[2-(2-pyridylamino)ethylamino]quinoline-3-carboxylic acid Formula: C23H26FN5O4 MolecularWeight: 455.482043

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C(=C(C2=C1N(C=C(C2=O)C(=O)O)C3CC3)N)F)NCCNC4=CC=CC=N4

Isomeric SMILES

CC(C)OC1=C(C(=C(C2=C1N(C=C(C2=O)C(=O)O)C3CC3)N)F)NCCNC4=CC=CC=N4

InChI

InChI=1S/C23H26FN5O4/c1-12(2)33-22-19(28-10-9-27-15-5-3-4-8-26-15)17(24)18(25)16-20(22)29(13-6-7-13)11-14(21(16)30)23(31)32/h3-5,8,11-13,28H,6-7,9-10,25H2,1-2H3,(H,26,27)(H,31,32)