dimethyl (E)-but-2-enedioate; propane-1,2-diol

Systemtic Name: dimethyl (E)-but-2-enedioate; propane-1,2-diol Openeye Name: dimethyl (E)-but-2-enedioate; propane-1,2-diol CAS Name: (E)-2-butenedioic acid dimethyl ester; propane-1,2-diol IUPAC Name: dimethyl (E)-but-2-enedioate; propane-1,2-diol Traditional Name: (E)-but-2-enedioic acid dimethyl ester; propane-1,2-diol Formula: C9H16O6 MolecularWeight: 220.21974

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Descriptors Computed from Structure

Canonical SMILES:

CC(CO)O.COC(=O)C=CC(=O)OC

Isomeric SMILES

CC(CO)O.COC(=O)/C=C/C(=O)OC

InChI

InChI=1S/C6H8O4.C3H8O2/c1-9-5(7)3-4-6(8)10-2;1-3(5)2-4/h3-4H,1-2H3;3-5H,2H2,1H3/b4-3+;