4-[2-(3-carboxyphenyl)propan-2-yl]phthalic acid

Systemtic Name: 4-[2-(3-carboxyphenyl)propan-2-yl]phthalic acid Openeye Name: 4-[1-(3-carboxyphenyl)-1-methyl-ethyl]phthalic acid CAS Name: 4-[2-(3-carboxyphenyl)propan-2-yl]phthalic acid IUPAC Name: 4-[2-(3-carboxyphenyl)propan-2-yl]phthalic acid Traditional Name: 4-[1-(3-carboxyphenyl)-1-methyl-ethyl]phthalic acid Formula: C18H16O6 MolecularWeight: 328.31604

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H16O6/c1-18(2,11-5-3-4-10(8-11)15(19)20)12-6-7-13(16(21)22)14(9-12)17(23)24/h3-9H,1-2H3,(H,19,20)(H,21,22)(H,23,24)