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

Systemtic Name: 5-azanyl-6-fluoranyl-8-methoxy-4-oxidanylidene-7-[2-(pyridin-2-ylamino)ethylamino]-1H-quinoline-3-carboxylic acid Openeye Name: 5-amino-6-fluoro-8-methoxy-4-oxo-7-[2-(2-pyridylamino)ethylamino]-1H-quinoline-3-carboxylic acid CAS Name: 5-amino-6-fluoro-8-methoxy-4-oxo-7-[2-(2-pyridinylamino)ethylamino]-1H-quinoline-3-carboxylic acid IUPAC Name: 5-amino-6-fluoro-8-methoxy-4-oxo-7-[2-(pyridin-2-ylamino)ethylamino]-1H-quinoline-3-carboxylic acid Traditional Name: 5-amino-6-fluoro-4-keto-8-methoxy-7-[2-(2-pyridylamino)ethylamino]-1H-quinoline-3-carboxylic acid Formula: C18H18FN5O4 MolecularWeight: 387.365023

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C2=C1NC=C(C2=O)C(=O)O)N)F)NCCNC3=CC=CC=N3

Isomeric SMILES

COC1=C(C(=C(C2=C1NC=C(C2=O)C(=O)O)N)F)NCCNC3=CC=CC=N3

InChI

InChI=1S/C18H18FN5O4/c1-28-17-14-11(16(25)9(8-24-14)18(26)27)13(20)12(19)15(17)23-7-6-22-10-4-2-3-5-21-10/h2-5,8,23H,6-7,20H2,1H3,(H,21,22)(H,24,25)(H,26,27)