1-butoxy-4-methyl-benzene; phthalic acid

Systemtic Name: 1-butoxy-4-methyl-benzene; phthalic acid Openeye Name: 1-butoxy-4-methyl-benzene; phthalic acid CAS Name: 1-butoxy-4-methylbenzene; phthalic acid IUPAC Name: 1-butoxy-4-methylbenzene; phthalic acid Traditional Name: 1-butoxy-4-methyl-benzene; phthalic acid Formula: C19H22O5 MolecularWeight: 330.37498

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C.C1=CC=C(C(=C1)C(=O)O)C(=O)O

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C.C1=CC=C(C(=C1)C(=O)O)C(=O)O

InChI

InChI=1S/C11H16O.C8H6O4/c1-3-4-9-12-11-7-5-10(2)6-8-11;9-7(10)5-3-1-2-4-6(5)8(11)12/h5-8H,3-4,9H2,1-2H3;1-4H,(H,9,10)(H,11,12)