2-[6-bromanyl-3-(4-hydroxyphenyl)-2-oxidanylidene-quinolin-1-yl]-3-methyl-butanoic acid

Systemtic Name: 2-[6-bromanyl-3-(4-hydroxyphenyl)-2-oxidanylidene-quinolin-1-yl]-3-methyl-butanoic acid Openeye Name: 2-[6-bromo-3-(4-hydroxyphenyl)-2-oxo-1-quinolyl]-3-methyl-butanoic acid CAS Name: 2-[6-bromo-3-(4-hydroxyphenyl)-2-oxo-1-quinolinyl]-3-methylbutanoic acid IUPAC Name: 2-[6-bromo-3-(4-hydroxyphenyl)-2-oxoquinolin-1-yl]-3-methylbutanoic acid Traditional Name: 2-[6-bromo-3-(4-hydroxyphenyl)-2-keto-1-quinolyl]-3-methyl-butyric acid Formula: C20H18BrNO4 MolecularWeight: 416.26522

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)N1C2=C(C=C(C=C2)Br)C=C(C1=O)C3=CC=C(C=C3)O

Isomeric SMILES

CC(C)C(C(=O)O)N1C2=C(C=C(C=C2)Br)C=C(C1=O)C3=CC=C(C=C3)O

InChI

InChI=1S/C20H18BrNO4/c1-11(2)18(20(25)26)22-17-8-5-14(21)9-13(17)10-16(19(22)24)12-3-6-15(23)7-4-12/h3-11,18,23H,1-2H3,(H,25,26)