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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CC2=CC=C(C=C2)Cl)C(=O)C(=O)[O-].[Na+]

Isomeric SMILES

C1=CC=C(C=C1)C(CC2=CC=C(C=C2)Cl)C(=O)C(=O)[O-].[Na+]

InChI

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