disodium 2,2-bis(4-chlorophenyl)butanedioate

Systemtic Name: disodium 2,2-bis(4-chlorophenyl)butanedioate Openeye Name: disodium 2,2-bis(4-chlorophenyl)butanedioate CAS Name: disodium 2,2-bis(4-chlorophenyl)butanedioate IUPAC Name: disodium 2,2-bis(4-chlorophenyl)butanedioate Traditional Name: disodium 2,2-bis(4-chlorophenyl)succinate Formula: C16H10Cl2Na2O4 MolecularWeight: 383.13374

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(CC(=O)[O-])(C2=CC=C(C=C2)Cl)C(=O)[O-])Cl.[Na+].[Na+]

Isomeric SMILES

C1=CC(=CC=C1C(CC(=O)[O-])(C2=CC=C(C=C2)Cl)C(=O)[O-])Cl.[Na+].[Na+]

InChI

InChI=1S/C16H12Cl2O4.2Na/c17-12-5-1-10(2-6-12)16(15(21)22,9-14(19)20)11-3-7-13(18)8-4-11;;/h1-8H,9H2,(H,19,20)(H,21,22);;/q;2*+1/p-2