(4-cyanobenzene-5-id-1-yl) 4-(4-methylcyclohexyl)benzoate; yttrium(3+)

Systemtic Name: (4-cyanobenzene-5-id-1-yl) 4-(4-methylcyclohexyl)benzoate; yttrium(3+) Openeye Name: (4-cyanobenzene-5-id-1-yl) 4-(4-methylcyclohexyl)benzoate; yttrium(3+) CAS Name: 4-(4-methylcyclohexyl)benzoic acid (4-cyano-1-benzene-5-idyl) ester; yttrium(3+) IUPAC Name: (4-cyanobenzene-5-id-1-yl) 4-(4-methylcyclohexyl)benzoate; yttrium(3+) Traditional Name: 4-(4-methylcyclohexyl)benzoic acid (4-cyanobenzene-5-id-1-yl) ester; yttrium(3+) Formula: C21H20NO2Y+2 MolecularWeight: 407.29485

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)C2=CC=C(C=C2)C(=O)OC3=CC=C([C-]=C3)C#N.[Y+3]

Isomeric SMILES

CC1CCC(CC1)C2=CC=C(C=C2)C(=O)OC3=CC=C([C-]=C3)C#N.[Y+3]

InChI

InChI=1S/C21H20NO2.Y/c1-15-2-6-17(7-3-15)18-8-10-19(11-9-18)21(23)24-20-12-4-16(14-22)5-13-20;/h4,8-13,15,17H,2-3,6-7H2,1H3;/q-1;+3