2-(2-hexoxyphenyl)benzenecarbonitrile; 2-methylprop-2-enoate

Systemtic Name: 2-(2-hexoxyphenyl)benzenecarbonitrile; 2-methylprop-2-enoate Openeye Name: 2-(2-hexoxyphenyl)benzonitrile; 2-methylprop-2-enoate CAS Name: 2-(2-hexoxyphenyl)benzonitrile; 2-methyl-2-propenoate IUPAC Name: 2-(2-hexoxyphenyl)benzonitrile; 2-methylprop-2-enoate Traditional Name: 2-(2-hexoxyphenyl)benzonitrile; methacrylate Formula: C23H26NO3- MolecularWeight: 364.45744

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=CC=C1C2=CC=CC=C2C#N.CC(=C)C(=O)[O-]

Isomeric SMILES

CCCCCCOC1=CC=CC=C1C2=CC=CC=C2C#N.CC(=C)C(=O)[O-]

InChI

InChI=1S/C19H21NO.C4H6O2/c1-2-3-4-9-14-21-19-13-8-7-12-18(19)17-11-6-5-10-16(17)15-20;1-3(2)4(5)6/h5-8,10-13H,2-4,9,14H2,1H3;1H2,2H3,(H,5,6)/p-1