3-[4-(2,2-dimethylpropyl)phenoxy]phthalic acid

Systemtic Name: 3-[4-(2,2-dimethylpropyl)phenoxy]phthalic acid Openeye Name: 3-[4-(2,2-dimethylpropyl)phenoxy]phthalic acid CAS Name: 3-[4-(2,2-dimethylpropyl)phenoxy]phthalic acid IUPAC Name: 3-[4-(2,2-dimethylpropyl)phenoxy]phthalic acid Traditional Name: 3-(4-neopentylphenoxy)phthalic acid Formula: C19H20O5 MolecularWeight: 328.3591

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC1=CC=C(C=C1)OC2=CC=CC(=C2C(=O)O)C(=O)O

Isomeric SMILES

CC(C)(C)CC1=CC=C(C=C1)OC2=CC=CC(=C2C(=O)O)C(=O)O

InChI

InChI=1S/C19H20O5/c1-19(2,3)11-12-7-9-13(10-8-12)24-15-6-4-5-14(17(20)21)16(15)18(22)23/h4-10H,11H2,1-3H3,(H,20,21)(H,22,23)