4-[3-[2-(4-methylphenyl)phenyl]prop-1-ynoxy]benzoic acid

Systemtic Name: 4-[3-[2-(4-methylphenyl)phenyl]prop-1-ynoxy]benzoic acid Openeye Name: 4-[3-[2-(p-tolyl)phenyl]prop-1-ynoxy]benzoic acid CAS Name: 4-[3-[2-(4-methylphenyl)phenyl]prop-1-ynoxy]benzoic acid IUPAC Name: 4-[3-[2-(4-methylphenyl)phenyl]prop-1-ynoxy]benzoic acid Traditional Name: 4-[3-[2-(p-tolyl)phenyl]prop-1-ynoxy]benzoic acid Formula: C23H18O3 MolecularWeight: 342.38722

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC=CC=C2CC#COC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC=CC=C2CC#COC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C23H18O3/c1-17-8-10-19(11-9-17)22-7-3-2-5-18(22)6-4-16-26-21-14-12-20(13-15-21)23(24)25/h2-3,5,7-15H,6H2,1H3,(H,24,25)