4-(2,6-dimethyl-4-propyl-phenoxy)phthalic acid

Systemtic Name: 4-(2,6-dimethyl-4-propyl-phenoxy)phthalic acid Openeye Name: 4-(2,6-dimethyl-4-propyl-phenoxy)phthalic acid CAS Name: 4-(2,6-dimethyl-4-propylphenoxy)phthalic acid IUPAC Name: 4-(2,6-dimethyl-4-propylphenoxy)phthalic acid Traditional Name: 4-(2,6-dimethyl-4-propyl-phenoxy)phthalic acid Formula: C19H20O5 MolecularWeight: 328.3591

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=C(C(=C1)C)OC2=CC(=C(C=C2)C(=O)O)C(=O)O)C

Isomeric SMILES

CCCC1=CC(=C(C(=C1)C)OC2=CC(=C(C=C2)C(=O)O)C(=O)O)C

InChI

InChI=1S/C19H20O5/c1-4-5-13-8-11(2)17(12(3)9-13)24-14-6-7-15(18(20)21)16(10-14)19(22)23/h6-10H,4-5H2,1-3H3,(H,20,21)(H,22,23)