butane; [4-carboxylatooxy-2-[3-oxidanylidene-3-(2-oxidanylidenecyclopentyl)propyl]phenyl] carbonate

Systemtic Name: butane; [4-carboxylatooxy-2-[3-oxidanylidene-3-(2-oxidanylidenecyclopentyl)propyl]phenyl] carbonate Openeye Name: butane; [4-carboxylatooxy-2-[3-oxo-3-(2-oxocyclopentyl)propyl]phenyl] carbonate CAS Name: butane; [4-carboxylatooxy-2-[3-oxo-3-(2-oxocyclopentyl)propyl]phenyl] carbonate IUPAC Name: butane; [4-carboxylatooxy-2-[3-oxo-3-(2-oxocyclopentyl)propyl]phenyl] carbonate Traditional Name: [4-carboxylatooxy-2-[3-keto-3-(2-ketocyclopentyl)propyl]phenyl] carbonate; n-butane Formula: C20H24O8-2 MolecularWeight: 392.39976

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Descriptors Computed from Structure

Canonical SMILES:

CCCC.C1CC(C(=O)C1)C(=O)CCC2=C(C=CC(=C2)OC(=O)[O-])OC(=O)[O-]

Isomeric SMILES

CCCC.C1CC(C(=O)C1)C(=O)CCC2=C(C=CC(=C2)OC(=O)[O-])OC(=O)[O-]

InChI

InChI=1S/C16H16O8.C4H10/c17-12-3-1-2-11(12)13(18)6-4-9-8-10(23-15(19)20)5-7-14(9)24-16(21)22;1-3-4-2/h5,7-8,11H,1-4,6H2,(H,19,20)(H,21,22);3-4H2,1-2H3/p-2