sodium 2-chloranylheptanedioate

Systemtic Name: sodium 2-chloranylheptanedioate Openeye Name: sodium 2-chloroheptanedioate CAS Name: sodium 2-chloroheptanedioate IUPAC Name: sodium 2-chloroheptanedioate Traditional Name: sodium 2-chloropimelate Formula: C7H9ClNaO4- MolecularWeight: 215.58673

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H11ClO4.Na/c8-5(7(11)12)3-1-2-4-6(9)10;/h5H,1-4H2,(H,9,10)(H,11,12);/q;+1/p-2