sodium 2-(4-bromophenyl)carbonyl-3-oxidanylidene-inden-1-olate

Systemtic Name: sodium 2-(4-bromophenyl)carbonyl-3-oxidanylidene-inden-1-olate Openeye Name: sodium 2-(4-bromobenzoyl)-3-oxo-inden-1-olate CAS Name: sodium 2-[(4-bromophenyl)-oxomethyl]-3-oxo-1-indenolate IUPAC Name: sodium 2-(4-bromobenzoyl)-3-oxoinden-1-olate Traditional Name: sodium 2-(4-bromobenzoyl)-3-keto-inden-1-olate Formula: C16H8BrNaO3 MolecularWeight: 351.12669

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(C2=O)C(=O)C3=CC=C(C=C3)Br)[O-].[Na+]

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(C2=O)C(=O)C3=CC=C(C=C3)Br)[O-].[Na+]

InChI

InChI=1S/C16H9BrO3.Na/c17-10-7-5-9(6-8-10)14(18)13-15(19)11-3-1-2-4-12(11)16(13)20;/h1-8,19H;/q;+1/p-1