benzene-1,3-dicarboxylic acid; 4-ethenoxybutan-1-ol

Systemtic Name: benzene-1,3-dicarboxylic acid; 4-ethenoxybutan-1-ol Openeye Name: isophthalic acid; 4-vinyloxybutan-1-ol CAS Name: benzene-1,3-dicarboxylic acid; 4-ethenoxy-1-butanol IUPAC Name: benzene-1,3-dicarboxylic acid; 4-ethenoxybutan-1-ol Traditional Name: isophthalic acid; 4-vinyloxybutan-1-ol Formula: C14H18O6 MolecularWeight: 282.28912

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H6O4.C6H12O2/c9-7(10)5-2-1-3-6(4-5)8(11)12;1-2-8-6-4-3-5-7/h1-4H,(H,9,10)(H,11,12);2,7H,1,3-6H2