4-[3-[4-(2,3-diethoxy-3-oxidanylidene-propyl)phenoxy]propoxy]-6-fluoranyl-2-methyl-quinoline-3-carboxylic acid

Systemtic Name: 4-[3-[4-(2,3-diethoxy-3-oxidanylidene-propyl)phenoxy]propoxy]-6-fluoranyl-2-methyl-quinoline-3-carboxylic acid Openeye Name: 4-[3-[4-(2,3-diethoxy-3-oxo-propyl)phenoxy]propoxy]-6-fluoro-2-methyl-quinoline-3-carboxylic acid CAS Name: 4-[3-[4-(2,3-diethoxy-3-oxopropyl)phenoxy]propoxy]-6-fluoro-2-methyl-3-quinolinecarboxylic acid IUPAC Name: 4-[3-[4-(2,3-diethoxy-3-oxopropyl)phenoxy]propoxy]-6-fluoro-2-methylquinoline-3-carboxylic acid Traditional Name: 4-[3-[4-(2,3-diethoxy-3-keto-propyl)phenoxy]propoxy]-6-fluoro-2-methyl-quinoline-3-carboxylic acid Formula: C27H30FNO7 MolecularWeight: 499.528003

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CC1=CC=C(C=C1)OCCCOC2=C(C(=NC3=C2C=C(C=C3)F)C)C(=O)O)C(=O)OCC

Isomeric SMILES

CCOC(CC1=CC=C(C=C1)OCCCOC2=C(C(=NC3=C2C=C(C=C3)F)C)C(=O)O)C(=O)OCC

InChI

InChI=1S/C27H30FNO7/c1-4-33-23(27(32)34-5-2)15-18-7-10-20(11-8-18)35-13-6-14-36-25-21-16-19(28)9-12-22(21)29-17(3)24(25)26(30)31/h7-12,16,23H,4-6,13-15H2,1-3H3,(H,30,31)