(E)-4-(3-bromophenyl)-2-oxidanylidene-3-quinolin-2-yl-but-3-enoic acid

Systemtic Name: (E)-4-(3-bromophenyl)-2-oxidanylidene-3-quinolin-2-yl-but-3-enoic acid Openeye Name: (E)-4-(3-bromophenyl)-2-oxo-3-(2-quinolyl)but-3-enoic acid CAS Name: (E)-4-(3-bromophenyl)-2-oxo-3-(2-quinolinyl)-3-butenoic acid IUPAC Name: (E)-4-(3-bromophenyl)-2-oxo-3-quinolin-2-ylbut-3-enoic acid Traditional Name: (E)-4-(3-bromophenyl)-2-keto-3-(2-quinolyl)but-3-enoic acid Formula: C19H12BrNO3 MolecularWeight: 382.20748

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)C(=CC3=CC(=CC=C3)Br)C(=O)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)/C(=C\C3=CC(=CC=C3)Br)/C(=O)C(=O)O

InChI

InChI=1S/C19H12BrNO3/c20-14-6-3-4-12(10-14)11-15(18(22)19(23)24)17-9-8-13-5-1-2-7-16(13)21-17/h1-11H,(H,23,24)/b15-11+