5-chloranyl-2-[(E)-4-(dimethylamino)-2-oxidanylidene-3-phenyl-but-3-enoyl]benzoic acid

Systemtic Name: 5-chloranyl-2-[(E)-4-(dimethylamino)-2-oxidanylidene-3-phenyl-but-3-enoyl]benzoic acid Openeye Name: 5-chloro-2-[(E)-4-(dimethylamino)-2-oxo-3-phenyl-but-3-enoyl]benzoic acid CAS Name: 5-chloro-2-[(E)-4-(dimethylamino)-1,2-dioxo-3-phenylbut-3-enyl]benzoic acid IUPAC Name: 5-chloro-2-[(E)-4-(dimethylamino)-2-oxo-3-phenylbut-3-enoyl]benzoic acid Traditional Name: 5-chloro-2-[(E)-4-(dimethylamino)-2-keto-3-phenyl-but-3-enoyl]benzoic acid Formula: C19H16ClNO4 MolecularWeight: 357.78764

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C=C(C1=CC=CC=C1)C(=O)C(=O)C2=C(C=C(C=C2)Cl)C(=O)O

Isomeric SMILES

CN(C)/C=C(\C1=CC=CC=C1)/C(=O)C(=O)C2=C(C=C(C=C2)Cl)C(=O)O

InChI

InChI=1S/C19H16ClNO4/c1-21(2)11-16(12-6-4-3-5-7-12)18(23)17(22)14-9-8-13(20)10-15(14)19(24)25/h3-11H,1-2H3,(H,24,25)/b16-11+