butane-1,3-diol; butane-1,4-diol; ethanoic acid; hexanedioic acid

Systemtic Name: butane-1,3-diol; butane-1,4-diol; ethanoic acid; hexanedioic acid Openeye Name: acetic acid; adipic acid; butane-1,3-diol; butane-1,4-diol CAS Name: acetic acid; butane-1,3-diol; butane-1,4-diol; hexanedioic acid IUPAC Name: acetic acid; butane-1,3-diol; butane-1,4-diol; hexanedioic acid Traditional Name: acetic acid; adipic acid; butane-1,3-diol; butane-1,4-diol Formula: C16H34O10 MolecularWeight: 386.43516

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCO)O.CC(=O)O.C(CCC(=O)O)CC(=O)O.C(CCO)CO

Isomeric SMILES

CC(CCO)O.CC(=O)O.C(CCC(=O)O)CC(=O)O.C(CCO)CO

InChI

InChI=1S/C6H10O4.2C4H10O2.C2H4O2/c7-5(8)3-1-2-4-6(9)10;1-4(6)2-3-5;5-3-1-2-4-6;1-2(3)4/h1-4H2,(H,7,8)(H,9,10);4-6H,2-3H2,1H3;5-6H,1-4H2;1H3,(H,3,4)