1,3-dimethyl-1-(phenylcarbonyl)-2H-naphthalene-2,6-dicarboxylic acid

Systemtic Name: 1,3-dimethyl-1-(phenylcarbonyl)-2H-naphthalene-2,6-dicarboxylic acid Openeye Name: 1-benzoyl-1,3-dimethyl-2H-naphthalene-2,6-dicarboxylic acid CAS Name: 1-benzoyl-1,3-dimethyl-2H-naphthalene-2,6-dicarboxylic acid IUPAC Name: 1-benzoyl-1,3-dimethyl-2H-naphthalene-2,6-dicarboxylic acid Traditional Name: 1-benzoyl-1,3-dimethyl-2H-naphthalene-2,6-dicarboxylic acid Formula: C21H18O5 MolecularWeight: 350.36462

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=CC(=C2)C(=O)O)C(C1C(=O)O)(C)C(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC2=C(C=CC(=C2)C(=O)O)C(C1C(=O)O)(C)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H18O5/c1-12-10-15-11-14(19(23)24)8-9-16(15)21(2,17(12)20(25)26)18(22)13-6-4-3-5-7-13/h3-11,17H,1-2H3,(H,23,24)(H,25,26)