(E)-3-(3-ethenyl-4-methyl-phenyl)but-2-enenitrile; yttrium(3+)

Systemtic Name: (E)-3-(3-ethenyl-4-methyl-phenyl)but-2-enenitrile; yttrium(3+) Openeye Name: (E)-3-(4-methyl-3-vinyl-phenyl)but-2-enenitrile; yttrium(3+) CAS Name: (E)-3-(3-ethenyl-4-methylphenyl)-2-butenenitrile; yttrium(3+) IUPAC Name: (E)-3-(3-ethenyl-4-methylphenyl)but-2-enenitrile; yttrium(3+) Traditional Name: (E)-3-(4-methyl-3-vinyl-phenyl)but-2-enenitrile; yttrium(3+) Formula: C13H12NY+2 MolecularWeight: 271.14693

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=CC#N)C)[C-]=C.[Y+3]

Isomeric SMILES

CC1=C(C=C(C=C1)/C(=C/C#N)/C)[C-]=C.[Y+3]

InChI

InChI=1S/C13H12N.Y/c1-4-12-9-13(6-5-10(12)2)11(3)7-8-14;/h5-7,9H,1H2,2-3H3;/q-1;+3/b11-7+;