disodium 2-ethyl-3-(1-phenylpropyl)butanedioate

Systemtic Name: disodium 2-ethyl-3-(1-phenylpropyl)butanedioate Openeye Name: disodium 2-ethyl-3-(1-phenylpropyl)butanedioate CAS Name: disodium 2-ethyl-3-(1-phenylpropyl)butanedioate IUPAC Name: disodium 2-ethyl-3-(1-phenylpropyl)butanedioate Traditional Name: disodium 2-ethyl-3-(1-phenylpropyl)succinate Formula: C15H18Na2O4 MolecularWeight: 308.28056

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H20O4.2Na/c1-3-11(10-8-6-5-7-9-10)13(15(18)19)12(4-2)14(16)17;;/h5-9,11-13H,3-4H2,1-2H3,(H,16,17)(H,18,19);;/q;2*+1/p-2