2-[2-methyl-3-[2-[3-(4-methylphenyl)prop-2-ynoxy]phenoxy]phenyl]ethanoic acid

Systemtic Name: 2-[2-methyl-3-[2-[3-(4-methylphenyl)prop-2-ynoxy]phenoxy]phenyl]ethanoic acid Openeye Name: 2-[2-methyl-3-[2-[3-(p-tolyl)prop-2-ynoxy]phenoxy]phenyl]acetic acid CAS Name: 2-[2-methyl-3-[2-[3-(4-methylphenyl)prop-2-ynoxy]phenoxy]phenyl]acetic acid IUPAC Name: 2-[2-methyl-3-[2-[3-(4-methylphenyl)prop-2-ynoxy]phenoxy]phenyl]acetic acid Traditional Name: 2-[2-methyl-3-[2-[3-(p-tolyl)prop-2-ynoxy]phenoxy]phenyl]acetic acid Formula: C25H22O4 MolecularWeight: 386.43978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C#CCOC2=CC=CC=C2OC3=CC=CC(=C3C)CC(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C#CCOC2=CC=CC=C2OC3=CC=CC(=C3C)CC(=O)O

InChI

InChI=1S/C25H22O4/c1-18-12-14-20(15-13-18)7-6-16-28-23-9-3-4-10-24(23)29-22-11-5-8-21(19(22)2)17-25(26)27/h3-5,8-15H,16-17H2,1-2H3,(H,26,27)