4-[(4-carboxylato-3-methyl-phenyl)methyl]-2-methyl-benzoate

Systemtic Name: 4-[(4-carboxylato-3-methyl-phenyl)methyl]-2-methyl-benzoate Openeye Name: 4-[(4-carboxylato-3-methyl-phenyl)methyl]-2-methyl-benzoate CAS Name: 4-[(4-carboxylato-3-methylphenyl)methyl]-2-methylbenzoate IUPAC Name: 4-[(4-carboxylato-3-methylphenyl)methyl]-2-methylbenzoate Traditional Name: 4-(4-carboxylato-3-methyl-benzyl)-2-methyl-benzoate Formula: C17H14O4-2 MolecularWeight: 282.29066

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)CC2=CC(=C(C=C2)C(=O)[O-])C)C(=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)CC2=CC(=C(C=C2)C(=O)[O-])C)C(=O)[O-]

InChI

InChI=1S/C17H16O4/c1-10-7-12(3-5-14(10)16(18)19)9-13-4-6-15(17(20)21)11(2)8-13/h3-8H,9H2,1-2H3,(H,18,19)(H,20,21)/p-2