(Z)-4-(4-methoxycarbonylphenyl)-2-oxidanylidene-3-quinolin-2-yl-but-3-enoic acid

Systemtic Name: (Z)-4-(4-methoxycarbonylphenyl)-2-oxidanylidene-3-quinolin-2-yl-but-3-enoic acid Openeye Name: (Z)-4-(4-methoxycarbonylphenyl)-2-oxo-3-(2-quinolyl)but-3-enoic acid CAS Name: (Z)-4-(4-methoxycarbonylphenyl)-2-oxo-3-(2-quinolinyl)-3-butenoic acid IUPAC Name: (Z)-4-(4-methoxycarbonylphenyl)-2-oxo-3-quinolin-2-ylbut-3-enoic acid Traditional Name: (Z)-4-(4-carbomethoxyphenyl)-2-keto-3-(2-quinolyl)but-3-enoic acid Formula: C21H15NO5 MolecularWeight: 361.3475

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C=C(C2=NC3=CC=CC=C3C=C2)C(=O)C(=O)O

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)/C=C(/C2=NC3=CC=CC=C3C=C2)\C(=O)C(=O)O

InChI

InChI=1S/C21H15NO5/c1-27-21(26)15-8-6-13(7-9-15)12-16(19(23)20(24)25)18-11-10-14-4-2-3-5-17(14)22-18/h2-12H,1H3,(H,24,25)/b16-12-