4-[1-(3-carboxyphenyl)propan-2-yl]phthalic acid

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=CC(=C1)C(=O)O)C2=CC(=C(C=C2)C(=O)O)C(=O)O

Isomeric SMILES

CC(CC1=CC=CC(=C1)C(=O)O)C2=CC(=C(C=C2)C(=O)O)C(=O)O

InChI

InChI=1S/C18H16O6/c1-10(7-11-3-2-4-13(8-11)16(19)20)12-5-6-14(17(21)22)15(9-12)18(23)24/h2-6,8-10H,7H2,1H3,(H,19,20)(H,21,22)(H,23,24)