5-(2,6-dimethylphenyl)carbonyl-6-methyl-1,3-benzodioxole-2-carboxylic acid

Systemtic Name: 5-(2,6-dimethylphenyl)carbonyl-6-methyl-1,3-benzodioxole-2-carboxylic acid Openeye Name: 5-(2,6-dimethylbenzoyl)-6-methyl-1,3-benzodioxole-2-carboxylic acid CAS Name: 5-[(2,6-dimethylphenyl)-oxomethyl]-6-methyl-1,3-benzodioxole-2-carboxylic acid IUPAC Name: 5-(2,6-dimethylbenzoyl)-6-methyl-1,3-benzodioxole-2-carboxylic acid Traditional Name: 5-(2,6-dimethylbenzoyl)-6-methyl-1,3-benzodioxole-2-carboxylic acid Formula: C18H16O5 MolecularWeight: 312.31664

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)C(=O)C2=CC3=C(C=C2C)OC(O3)C(=O)O

Isomeric SMILES

CC1=C(C(=CC=C1)C)C(=O)C2=CC3=C(C=C2C)OC(O3)C(=O)O

InChI

InChI=1S/C18H16O5/c1-9-5-4-6-10(2)15(9)16(19)12-8-14-13(7-11(12)3)22-18(23-14)17(20)21/h4-8,18H,1-3H3,(H,20,21)