2-(cyclohexylcarbamoylamino)-3-[4-[2-(5-ethylpyridin-2-yl)ethoxy]phenyl]propanoic acid

Systemtic Name: 2-(cyclohexylcarbamoylamino)-3-[4-[2-(5-ethylpyridin-2-yl)ethoxy]phenyl]propanoic acid Openeye Name: 2-(cyclohexylcarbamoylamino)-3-[4-[2-(5-ethyl-2-pyridyl)ethoxy]phenyl]propanoic acid CAS Name: 2-[[(cyclohexylamino)-oxomethyl]amino]-3-[4-[2-(5-ethyl-2-pyridinyl)ethoxy]phenyl]propanoic acid IUPAC Name: 2-(cyclohexylcarbamoylamino)-3-[4-[2-(5-ethylpyridin-2-yl)ethoxy]phenyl]propanoic acid Traditional Name: 2-(cyclohexylcarbamoylamino)-3-[4-[2-(5-ethyl-2-pyridyl)ethoxy]phenyl]propionic acid Formula: C25H33N3O4 MolecularWeight: 439.54722

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CN=C(C=C1)CCOC2=CC=C(C=C2)CC(C(=O)O)NC(=O)NC3CCCCC3

Isomeric SMILES

CCC1=CN=C(C=C1)CCOC2=CC=C(C=C2)CC(C(=O)O)NC(=O)NC3CCCCC3

InChI

InChI=1S/C25H33N3O4/c1-2-18-8-11-20(26-17-18)14-15-32-22-12-9-19(10-13-22)16-23(24(29)30)28-25(31)27-21-6-4-3-5-7-21/h8-13,17,21,23H,2-7,14-16H2,1H3,(H,29,30)(H2,27,28,31)