sodium 3-(4-chlorophenyl)-2-oxidanylidene-4-phenyl-butanoate

Systemtic Name: sodium 3-(4-chlorophenyl)-2-oxidanylidene-4-phenyl-butanoate Openeye Name: sodium 3-(4-chlorophenyl)-2-oxo-4-phenyl-butanoate CAS Name: sodium 3-(4-chlorophenyl)-2-oxo-4-phenylbutanoate IUPAC Name: sodium 3-(4-chlorophenyl)-2-oxo-4-phenylbutanoate Traditional Name: sodium 3-(4-chlorophenyl)-2-keto-4-phenyl-butyrate Formula: C16H12ClNaO3 MolecularWeight: 310.70745

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C2=CC=C(C=C2)Cl)C(=O)C(=O)[O-].[Na+]

Isomeric SMILES

C1=CC=C(C=C1)CC(C2=CC=C(C=C2)Cl)C(=O)C(=O)[O-].[Na+]

InChI

InChI=1S/C16H13ClO3.Na/c17-13-8-6-12(7-9-13)14(15(18)16(19)20)10-11-4-2-1-3-5-11;/h1-9,14H,10H2,(H,19,20);/q;+1/p-1