2-[4-[4-[3-(3-phenoxypropoxy)-1H-pyrazol-5-yl]phenyl]cyclohexyl]ethanoic acid

Systemtic Name: 2-[4-[4-[3-(3-phenoxypropoxy)-1H-pyrazol-5-yl]phenyl]cyclohexyl]ethanoic acid Openeye Name: 2-[4-[4-[3-(3-phenoxypropoxy)-1H-pyrazol-5-yl]phenyl]cyclohexyl]acetic acid CAS Name: 2-[4-[4-[3-(3-phenoxypropoxy)-1H-pyrazol-5-yl]phenyl]cyclohexyl]acetic acid IUPAC Name: 2-[4-[4-[3-(3-phenoxypropoxy)-1H-pyrazol-5-yl]phenyl]cyclohexyl]acetic acid Traditional Name: 2-[4-[4-[3-(3-phenoxypropoxy)-1H-pyrazol-5-yl]phenyl]cyclohexyl]acetic acid Formula: C26H30N2O4 MolecularWeight: 434.5274

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1CC(=O)O)C2=CC=C(C=C2)C3=CC(=NN3)OCCCOC4=CC=CC=C4

Isomeric SMILES

C1CC(CCC1CC(=O)O)C2=CC=C(C=C2)C3=CC(=NN3)OCCCOC4=CC=CC=C4

InChI

InChI=1S/C26H30N2O4/c29-26(30)17-19-7-9-20(10-8-19)21-11-13-22(14-12-21)24-18-25(28-27-24)32-16-4-15-31-23-5-2-1-3-6-23/h1-3,5-6,11-14,18-20H,4,7-10,15-17H2,(H,27,28)(H,29,30)