2-[4-[2-[3-(cyclohexylcarbamoylamino)phenyl]ethyl]phenoxy]-2-methyl-propanoic acid

Systemtic Name: 2-[4-[2-[3-(cyclohexylcarbamoylamino)phenyl]ethyl]phenoxy]-2-methyl-propanoic acid Openeye Name: 2-[4-[2-[3-(cyclohexylcarbamoylamino)phenyl]ethyl]phenoxy]-2-methyl-propanoic acid CAS Name: 2-[4-[2-[3-[[(cyclohexylamino)-oxomethyl]amino]phenyl]ethyl]phenoxy]-2-methylpropanoic acid IUPAC Name: 2-[4-[2-[3-(cyclohexylcarbamoylamino)phenyl]ethyl]phenoxy]-2-methylpropanoic acid Traditional Name: 2-[4-[2-[3-(cyclohexylcarbamoylamino)phenyl]ethyl]phenoxy]-2-methyl-propionic acid Formula: C25H32N2O4 MolecularWeight: 424.53258

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)O)OC1=CC=C(C=C1)CCC2=CC(=CC=C2)NC(=O)NC3CCCCC3

Isomeric SMILES

CC(C)(C(=O)O)OC1=CC=C(C=C1)CCC2=CC(=CC=C2)NC(=O)NC3CCCCC3

InChI

InChI=1S/C25H32N2O4/c1-25(2,23(28)29)31-22-15-13-18(14-16-22)11-12-19-7-6-10-21(17-19)27-24(30)26-20-8-4-3-5-9-20/h6-7,10,13-17,20H,3-5,8-9,11-12H2,1-2H3,(H,28,29)(H2,26,27,30)