5-benzamido-5-(2,4-dimethylphenoxy)-2,2-dimethyl-pentanoic acid

Systemtic Name: 5-benzamido-5-(2,4-dimethylphenoxy)-2,2-dimethyl-pentanoic acid Openeye Name: 5-benzamido-5-(2,4-dimethylphenoxy)-2,2-dimethyl-pentanoic acid CAS Name: 5-benzamido-5-(2,4-dimethylphenoxy)-2,2-dimethylpentanoic acid IUPAC Name: 5-benzamido-5-(2,4-dimethylphenoxy)-2,2-dimethylpentanoic acid Traditional Name: 5-benzamido-5-(2,4-dimethylphenoxy)-2,2-dimethyl-valeric acid Formula: C22H27NO4 MolecularWeight: 369.45408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC(CCC(C)(C)C(=O)O)NC(=O)C2=CC=CC=C2)C

Isomeric SMILES

CC1=CC(=C(C=C1)OC(CCC(C)(C)C(=O)O)NC(=O)C2=CC=CC=C2)C

InChI

InChI=1S/C22H27NO4/c1-15-10-11-18(16(2)14-15)27-19(12-13-22(3,4)21(25)26)23-20(24)17-8-6-5-7-9-17/h5-11,14,19H,12-13H2,1-4H3,(H,23,24)(H,25,26)