(Z)-4-[4-[(4-fluorophenyl)methoxy]-3-methoxy-phenyl]-2-oxidanylidene-3-quinolin-2-yl-but-3-enoic acid

Systemtic Name: (Z)-4-[4-[(4-fluorophenyl)methoxy]-3-methoxy-phenyl]-2-oxidanylidene-3-quinolin-2-yl-but-3-enoic acid Openeye Name: (Z)-4-[4-[(4-fluorophenyl)methoxy]-3-methoxy-phenyl]-2-oxo-3-(2-quinolyl)but-3-enoic acid CAS Name: (Z)-4-[4-[(4-fluorophenyl)methoxy]-3-methoxyphenyl]-2-oxo-3-(2-quinolinyl)-3-butenoic acid IUPAC Name: (Z)-4-[4-[(4-fluorophenyl)methoxy]-3-methoxyphenyl]-2-oxo-3-quinolin-2-ylbut-3-enoic acid Traditional Name: (Z)-4-[4-(4-fluorobenzyl)oxy-3-methoxy-phenyl]-2-keto-3-(2-quinolyl)but-3-enoic acid Formula: C27H20FNO5 MolecularWeight: 457.449803

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C(C2=NC3=CC=CC=C3C=C2)C(=O)C(=O)O)OCC4=CC=C(C=C4)F

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C(/C2=NC3=CC=CC=C3C=C2)\C(=O)C(=O)O)OCC4=CC=C(C=C4)F

InChI

InChI=1S/C27H20FNO5/c1-33-25-15-18(8-13-24(25)34-16-17-6-10-20(28)11-7-17)14-21(26(30)27(31)32)23-12-9-19-4-2-3-5-22(19)29-23/h2-15H,16H2,1H3,(H,31,32)/b21-14-