2-[[4-[3-(cyclobutylmethylcarbamoyl)-4-oxidanyl-phenoxy]-3,5-dimethyl-phenyl]amino]-2-oxidanylidene-ethanoic acid

Systemtic Name: 2-[[4-[3-(cyclobutylmethylcarbamoyl)-4-oxidanyl-phenoxy]-3,5-dimethyl-phenyl]amino]-2-oxidanylidene-ethanoic acid Openeye Name: 2-[4-[3-(cyclobutylmethylcarbamoyl)-4-hydroxy-phenoxy]-3,5-dimethyl-anilino]-2-oxo-acetic acid CAS Name: 2-[4-[3-[(cyclobutylmethylamino)-oxomethyl]-4-hydroxyphenoxy]-3,5-dimethylanilino]-2-oxoacetic acid IUPAC Name: 2-[4-[3-(cyclobutylmethylcarbamoyl)-4-hydroxyphenoxy]-3,5-dimethylanilino]-2-oxoacetic acid Traditional Name: 2-[4-[3-(cyclobutylmethylcarbamoyl)-4-hydroxy-phenoxy]-3,5-dimethyl-anilino]-2-keto-acetic acid Formula: C22H24N2O6 MolecularWeight: 412.43576

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OC2=CC(=C(C=C2)O)C(=O)NCC3CCC3)C)NC(=O)C(=O)O

Isomeric SMILES

CC1=CC(=CC(=C1OC2=CC(=C(C=C2)O)C(=O)NCC3CCC3)C)NC(=O)C(=O)O

InChI

InChI=1S/C22H24N2O6/c1-12-8-15(24-21(27)22(28)29)9-13(2)19(12)30-16-6-7-18(25)17(10-16)20(26)23-11-14-4-3-5-14/h6-10,14,25H,3-5,11H2,1-2H3,(H,23,26)(H,24,27)(H,28,29)