4,6-bis(chloranyl)-3-[(E)-4-oxidanyl-4-oxidanylidene-3-phenyl-but-2-enyl]-1H-indole-2-carboxylic acid

Systemtic Name: 4,6-bis(chloranyl)-3-[(E)-4-oxidanyl-4-oxidanylidene-3-phenyl-but-2-enyl]-1H-indole-2-carboxylic acid Openeye Name: 4,6-dichloro-3-[(E)-4-hydroxy-4-oxo-3-phenyl-but-2-enyl]-1H-indole-2-carboxylic acid CAS Name: 4,6-dichloro-3-[(E)-4-hydroxy-4-oxo-3-phenylbut-2-enyl]-1H-indole-2-carboxylic acid IUPAC Name: 4,6-dichloro-3-[(E)-4-hydroxy-4-oxo-3-phenylbut-2-enyl]-1H-indole-2-carboxylic acid Traditional Name: 4,6-dichloro-3-[(E)-4-hydroxy-4-keto-3-phenyl-but-2-enyl]-1H-indole-2-carboxylic acid Formula: C19H13Cl2NO4 MolecularWeight: 390.21682

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=CCC2=C(NC3=CC(=CC(=C32)Cl)Cl)C(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)/C(=C\CC2=C(NC3=CC(=CC(=C32)Cl)Cl)C(=O)O)/C(=O)O

InChI

InChI=1S/C19H13Cl2NO4/c20-11-8-14(21)16-13(17(19(25)26)22-15(16)9-11)7-6-12(18(23)24)10-4-2-1-3-5-10/h1-6,8-9,22H,7H2,(H,23,24)(H,25,26)/b12-6+