2-[4-[2-[(3,5-dimethylphenyl)amino]-2-oxidanylidene-ethyl]phenoxy]pentanoic acid

Systemtic Name: 2-[4-[2-[(3,5-dimethylphenyl)amino]-2-oxidanylidene-ethyl]phenoxy]pentanoic acid Openeye Name: 2-[4-[2-(3,5-dimethylanilino)-2-oxo-ethyl]phenoxy]pentanoic acid CAS Name: 2-[4-[2-(3,5-dimethylanilino)-2-oxoethyl]phenoxy]pentanoic acid IUPAC Name: 2-[4-[2-(3,5-dimethylanilino)-2-oxoethyl]phenoxy]pentanoic acid Traditional Name: 2-[4-[2-(3,5-dimethylanilino)-2-keto-ethyl]phenoxy]valeric acid Formula: C21H25NO4 MolecularWeight: 355.4275

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)O)OC1=CC=C(C=C1)CC(=O)NC2=CC(=CC(=C2)C)C

Isomeric SMILES

CCCC(C(=O)O)OC1=CC=C(C=C1)CC(=O)NC2=CC(=CC(=C2)C)C

InChI

InChI=1S/C21H25NO4/c1-4-5-19(21(24)25)26-18-8-6-16(7-9-18)13-20(23)22-17-11-14(2)10-15(3)12-17/h6-12,19H,4-5,13H2,1-3H3,(H,22,23)(H,24,25)