decanedioic acid; phenyl butanoate

Systemtic Name: decanedioic acid; phenyl butanoate Openeye Name: decanedioic acid; phenyl butanoate CAS Name: butanoic acid phenyl ester; decanedioic acid IUPAC Name: decanedioic acid; phenyl butanoate Traditional Name: butyric acid phenyl ester; sebacic acid Formula: C20H30O6 MolecularWeight: 366.4486

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OC1=CC=CC=C1.C(CCCCC(=O)O)CCCC(=O)O

Isomeric SMILES

CCCC(=O)OC1=CC=CC=C1.C(CCCCC(=O)O)CCCC(=O)O

InChI

InChI=1S/C10H18O4.C10H12O2/c11-9(12)7-5-3-1-2-4-6-8-10(13)14;1-2-6-10(11)12-9-7-4-3-5-8-9/h1-8H2,(H,11,12)(H,13,14);3-5,7-8H,2,6H2,1H3