1-cyclopropyl-7-[2-(dodecylamino)ethylamino]-6-fluoranyl-8-methoxy-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-7-[2-(dodecylamino)ethylamino]-6-fluoranyl-8-methoxy-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-7-[2-(dodecylamino)ethylamino]-6-fluoro-8-methoxy-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-7-[2-(dodecylamino)ethylamino]-6-fluoro-8-methoxy-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-7-[2-(dodecylamino)ethylamino]-6-fluoro-8-methoxy-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-6-fluoro-4-keto-7-[2-(laurylamino)ethylamino]-8-methoxy-quinoline-3-carboxylic acid Formula: C28H42FN3O4 MolecularWeight: 503.649183

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCNCCNC1=C(C=C2C(=C1OC)N(C=C(C2=O)C(=O)O)C3CC3)F

Isomeric SMILES

CCCCCCCCCCCCNCCNC1=C(C=C2C(=C1OC)N(C=C(C2=O)C(=O)O)C3CC3)F

InChI

InChI=1S/C28H42FN3O4/c1-3-4-5-6-7-8-9-10-11-12-15-30-16-17-31-24-23(29)18-21-25(27(24)36-2)32(20-13-14-20)19-22(26(21)33)28(34)35/h18-20,30-31H,3-17H2,1-2H3,(H,34,35)