butane; hexanedioate

Systemtic Name: butane; hexanedioate Openeye Name: butane; hexanedioate CAS Name: butane; hexanedioate IUPAC Name: butane; hexanedioate Traditional Name: adipate; n-butane Formula: C10H18O4-2 MolecularWeight: 202.24752

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Descriptors Computed from Structure

Canonical SMILES:

CCCC.C(CCC(=O)[O-])CC(=O)[O-]

Isomeric SMILES

CCCC.C(CCC(=O)[O-])CC(=O)[O-]

InChI

InChI=1S/C6H10O4.C4H10/c7-5(8)3-1-2-4-6(9)10;1-3-4-2/h1-4H2,(H,7,8)(H,9,10);3-4H2,1-2H3/p-2