3-(3,4-dimethyl-5-naphthalen-2-yl-phenyl)propanoic acid; yttrium

Systemtic Name: 3-(3,4-dimethyl-5-naphthalen-2-yl-phenyl)propanoic acid; yttrium Openeye Name: 3-[3,4-dimethyl-5-(2-naphthyl)phenyl]propanoic acid; yttrium CAS Name: 3-[3,4-dimethyl-5-(2-naphthalenyl)phenyl]propanoic acid; yttrium IUPAC Name: 3-(3,4-dimethyl-5-naphthalen-2-ylphenyl)propanoic acid; yttrium Traditional Name: 3-[3,4-dimethyl-5-(2-naphthyl)phenyl]propionic acid; yttrium Formula: C21H20O2Y MolecularWeight: 393.28815

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)CCC(=O)O)C2=CC3=CC=CC=C3C=C2)C.[Y]

Isomeric SMILES

CC1=C(C(=CC(=C1)CCC(=O)O)C2=CC3=CC=CC=C3C=C2)C.[Y]

InChI

InChI=1S/C21H20O2.Y/c1-14-11-16(7-10-21(22)23)12-20(15(14)2)19-9-8-17-5-3-4-6-18(17)13-19;/h3-6,8-9,11-13H,7,10H2,1-2H3,(H,22,23);