5-(4-acetamido-2,5-dimethyl-phenoxy)-2,2-dimethyl-pentanoic acid

Systemtic Name: 5-(4-acetamido-2,5-dimethyl-phenoxy)-2,2-dimethyl-pentanoic acid Openeye Name: 5-(4-acetamido-2,5-dimethyl-phenoxy)-2,2-dimethyl-pentanoic acid CAS Name: 5-(4-acetamido-2,5-dimethylphenoxy)-2,2-dimethylpentanoic acid IUPAC Name: 5-(4-acetamido-2,5-dimethylphenoxy)-2,2-dimethylpentanoic acid Traditional Name: 5-(4-acetamido-2,5-dimethyl-phenoxy)-2,2-dimethyl-valeric acid Formula: C17H25NO4 MolecularWeight: 307.3847

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1OCCCC(C)(C)C(=O)O)C)NC(=O)C

Isomeric SMILES

CC1=CC(=C(C=C1OCCCC(C)(C)C(=O)O)C)NC(=O)C

InChI

InChI=1S/C17H25NO4/c1-11-10-15(12(2)9-14(11)18-13(3)19)22-8-6-7-17(4,5)16(20)21/h9-10H,6-8H2,1-5H3,(H,18,19)(H,20,21)