6-but-3-enyl-7-methyl-1,3,5-trioxepane-2,4-dione

Systemtic Name: 6-but-3-enyl-7-methyl-1,3,5-trioxepane-2,4-dione Openeye Name: 6-but-3-enyl-7-methyl-1,3,5-trioxepane-2,4-dione CAS Name: 6-but-3-enyl-7-methyl-1,3,5-trioxepane-2,4-dione IUPAC Name: 6-but-3-enyl-7-methyl-1,3,5-trioxepane-2,4-dione Traditional Name: 6-but-3-enyl-7-methyl-1,3,5-trioxepane-2,4-quinone Formula: C9H12O5 MolecularWeight: 200.18858

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(OC(=O)OC(=O)O1)CCC=C

Isomeric SMILES

CC1C(OC(=O)OC(=O)O1)CCC=C

InChI

InChI=1S/C9H12O5/c1-3-4-5-7-6(2)12-8(10)14-9(11)13-7/h3,6-7H,1,4-5H2,2H3