1-cyclopropyl-7-[3-(decylamino)propylamino]-6-fluoranyl-8-methoxy-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-7-[3-(decylamino)propylamino]-6-fluoranyl-8-methoxy-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-7-[3-(decylamino)propylamino]-6-fluoro-8-methoxy-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-7-[3-(decylamino)propylamino]-6-fluoro-8-methoxy-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-7-[3-(decylamino)propylamino]-6-fluoro-8-methoxy-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-7-[3-(decylamino)propylamino]-6-fluoro-4-keto-8-methoxy-quinoline-3-carboxylic acid Formula: C27H40FN3O4 MolecularWeight: 489.622603

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCNCCCNC1=C(C=C2C(=C1OC)N(C=C(C2=O)C(=O)O)C3CC3)F

Isomeric SMILES

CCCCCCCCCCNCCCNC1=C(C=C2C(=C1OC)N(C=C(C2=O)C(=O)O)C3CC3)F

InChI

InChI=1S/C27H40FN3O4/c1-3-4-5-6-7-8-9-10-14-29-15-11-16-30-23-22(28)17-20-24(26(23)35-2)31(19-12-13-19)18-21(25(20)32)27(33)34/h17-19,29-30H,3-16H2,1-2H3,(H,33,34)