benzoic acid; hexane-1,2,3,4,5,6-hexol; propane-2,2-diol

Systemtic Name: benzoic acid; hexane-1,2,3,4,5,6-hexol; propane-2,2-diol Openeye Name: benzoic acid; hexane-1,2,3,4,5,6-hexol; propane-2,2-diol CAS Name: benzoic acid; hexane-1,2,3,4,5,6-hexol; propane-2,2-diol IUPAC Name: benzoic acid; hexane-1,2,3,4,5,6-hexol; propane-2,2-diol Traditional Name: benzoic acid; hexane-1,2,3,4,5,6-hexol; propane-2,2-diol Formula: C16H28O10 MolecularWeight: 380.38752

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(O)O.C1=CC=C(C=C1)C(=O)O.C(C(C(C(C(CO)O)O)O)O)O

Isomeric SMILES

CC(C)(O)O.C1=CC=C(C=C1)C(=O)O.C(C(C(C(C(CO)O)O)O)O)O

InChI

InChI=1S/C7H6O2.C6H14O6.C3H8O2/c8-7(9)6-4-2-1-3-5-6;7-1-3(9)5(11)6(12)4(10)2-8;1-3(2,4)5/h1-5H,(H,8,9);3-12H,1-2H2;4-5H,1-2H3