[4-(3,4-dimethylbenzene-5-id-1-yl)phenyl] 4-methylbenzoate; yttrium(3+)

Systemtic Name: [4-(3,4-dimethylbenzene-5-id-1-yl)phenyl] 4-methylbenzoate; yttrium(3+) Openeye Name: [4-(3,4-dimethylbenzene-5-id-1-yl)phenyl] 4-methylbenzoate; yttrium(3+) CAS Name: 4-methylbenzoic acid [4-(3,4-dimethyl-1-benzene-5-idyl)phenyl] ester; yttrium(3+) IUPAC Name: [4-(3,4-dimethylbenzene-5-id-1-yl)phenyl] 4-methylbenzoate; yttrium(3+) Traditional Name: 4-methylbenzoic acid [4-(3,4-dimethylbenzene-5-id-1-yl)phenyl] ester; yttrium(3+) Formula: C22H19O2Y+2 MolecularWeight: 404.29091

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C3=CC(=C([C-]=C3)C)C.[Y+3]

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C3=CC(=C([C-]=C3)C)C.[Y+3]

InChI

InChI=1S/C22H19O2.Y/c1-15-4-7-19(8-5-15)22(23)24-21-12-10-18(11-13-21)20-9-6-16(2)17(3)14-20;/h4-5,7-14H,1-3H3;/q-1;+3