4-[2-[4-(2-tert-butyl-6-methyl-phenoxy)phenyl]ethylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[2-[4-(2-tert-butyl-6-methyl-phenoxy)phenyl]ethylamino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[2-[4-(2-tert-butyl-6-methyl-phenoxy)phenyl]ethylamino]-4-oxo-butanoic acid CAS Name: 4-[2-[4-(2-tert-butyl-6-methylphenoxy)phenyl]ethylamino]-4-oxobutanoic acid IUPAC Name: 4-[2-[4-(2-tert-butyl-6-methylphenoxy)phenyl]ethylamino]-4-oxobutanoic acid Traditional Name: 4-[2-[4-(2-tert-butyl-6-methyl-phenoxy)phenyl]ethylamino]-4-keto-butyric acid Formula: C23H29NO4 MolecularWeight: 383.48066

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C(C)(C)C)OC2=CC=C(C=C2)CCNC(=O)CCC(=O)O

Isomeric SMILES

CC1=C(C(=CC=C1)C(C)(C)C)OC2=CC=C(C=C2)CCNC(=O)CCC(=O)O

InChI

InChI=1S/C23H29NO4/c1-16-6-5-7-19(23(2,3)4)22(16)28-18-10-8-17(9-11-18)14-15-24-20(25)12-13-21(26)27/h5-11H,12-15H2,1-4H3,(H,24,25)(H,26,27)