5-methyl-2-[2-[(2-methylphenyl)methyl]-3-oxidanyl-3-oxidanylidene-propyl]benzoic acid

Systemtic Name: 5-methyl-2-[2-[(2-methylphenyl)methyl]-3-oxidanyl-3-oxidanylidene-propyl]benzoic acid Openeye Name: 2-[3-hydroxy-2-(o-tolylmethyl)-3-oxo-propyl]-5-methyl-benzoic acid CAS Name: 2-[3-hydroxy-2-[(2-methylphenyl)methyl]-3-oxopropyl]-5-methylbenzoic acid IUPAC Name: 2-[3-hydroxy-2-[(2-methylphenyl)methyl]-3-oxopropyl]-5-methylbenzoic acid Traditional Name: 2-[3-hydroxy-3-keto-2-(2-methylbenzyl)propyl]-5-methyl-benzoic acid Formula: C19H20O4 MolecularWeight: 312.3597

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)CC(CC2=CC=CC=C2C)C(=O)O)C(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)CC(CC2=CC=CC=C2C)C(=O)O)C(=O)O

InChI

InChI=1S/C19H20O4/c1-12-7-8-15(17(9-12)19(22)23)11-16(18(20)21)10-14-6-4-3-5-13(14)2/h3-9,16H,10-11H2,1-2H3,(H,20,21)(H,22,23)