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

Systemtic Name: [4-(3,4-dimethylbenzene-5-id-1-yl)oxycarbonylphenyl] 4-methylbenzoate; yttrium(3+) Openeye Name: [4-(3,4-dimethylbenzene-5-id-1-yl)oxycarbonylphenyl] 4-methylbenzoate; yttrium(3+) CAS Name: 4-methylbenzoic acid [4-[(3,4-dimethyl-1-benzene-5-idyl)oxy-oxomethyl]phenyl] ester; yttrium(3+) IUPAC Name: [4-(3,4-dimethylbenzene-5-id-1-yl)oxycarbonylphenyl] 4-methylbenzoate; yttrium(3+) Traditional Name: 4-methylbenzoic acid [4-(3,4-dimethylbenzene-5-id-1-yl)oxycarbonylphenyl] ester; yttrium(3+) Formula: C23H19O4Y+2 MolecularWeight: 448.30041

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=O)OC3=CC(=C([C-]=C3)C)C.[Y+3]

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=O)OC3=CC(=C([C-]=C3)C)C.[Y+3]

InChI

InChI=1S/C23H19O4.Y/c1-15-4-7-18(8-5-15)22(24)26-20-12-9-19(10-13-20)23(25)27-21-11-6-16(2)17(3)14-21;/h4-5,7-14H,1-3H3;/q-1;+3