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

Systemtic Name: 2-[4-[2-[(3,5-dimethylphenyl)amino]-2-oxidanylidene-ethyl]phenoxy]-3-methoxy-2-methyl-propanoic acid Openeye Name: 2-[4-[2-(3,5-dimethylanilino)-2-oxo-ethyl]phenoxy]-3-methoxy-2-methyl-propanoic acid CAS Name: 2-[4-[2-(3,5-dimethylanilino)-2-oxoethyl]phenoxy]-3-methoxy-2-methylpropanoic acid IUPAC Name: 2-[4-[2-(3,5-dimethylanilino)-2-oxoethyl]phenoxy]-3-methoxy-2-methylpropanoic acid Traditional Name: 2-[4-[2-(3,5-dimethylanilino)-2-keto-ethyl]phenoxy]-3-methoxy-2-methyl-propionic acid Formula: C21H25NO5 MolecularWeight: 371.4269

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=O)CC2=CC=C(C=C2)OC(C)(COC)C(=O)O)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=O)CC2=CC=C(C=C2)OC(C)(COC)C(=O)O)C

InChI

InChI=1S/C21H25NO5/c1-14-9-15(2)11-17(10-14)22-19(23)12-16-5-7-18(8-6-16)27-21(3,13-26-4)20(24)25/h5-11H,12-13H2,1-4H3,(H,22,23)(H,24,25)