4-[2-[4-(5-methyl-2-propan-2-yl-phenoxy)phenyl]ethylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[2-[4-(5-methyl-2-propan-2-yl-phenoxy)phenyl]ethylamino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[2-[4-(2-isopropyl-5-methyl-phenoxy)phenyl]ethylamino]-4-oxo-butanoic acid CAS Name: 4-[2-[4-(5-methyl-2-propan-2-ylphenoxy)phenyl]ethylamino]-4-oxobutanoic acid IUPAC Name: 4-[2-[4-(5-methyl-2-propan-2-ylphenoxy)phenyl]ethylamino]-4-oxobutanoic acid Traditional Name: 4-[2-[4-(2-isopropyl-5-methyl-phenoxy)phenyl]ethylamino]-4-keto-butyric acid Formula: C22H27NO4 MolecularWeight: 369.45408

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27NO4/c1-15(2)19-9-4-16(3)14-20(19)27-18-7-5-17(6-8-18)12-13-23-21(24)10-11-22(25)26/h4-9,14-15H,10-13H2,1-3H3,(H,23,24)(H,25,26)