2-ethylhexyl (E)-2-cyano-3-(4-methoxyphenyl)prop-2-enoate

Systemtic Name: 2-ethylhexyl (E)-2-cyano-3-(4-methoxyphenyl)prop-2-enoate Openeye Name: 2-ethylhexyl (E)-2-cyano-3-(4-methoxyphenyl)prop-2-enoate CAS Name: (E)-2-cyano-3-(4-methoxyphenyl)-2-propenoic acid 2-ethylhexyl ester IUPAC Name: 2-ethylhexyl (E)-2-cyano-3-(4-methoxyphenyl)prop-2-enoate Traditional Name: (E)-2-cyano-3-(4-methoxyphenyl)acrylic acid 2-ethylhexyl ester Formula: C19H25NO3 MolecularWeight: 315.4067

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)COC(=O)C(=CC1=CC=C(C=C1)OC)C#N

Isomeric SMILES

CCCCC(CC)COC(=O)/C(=C/C1=CC=C(C=C1)OC)/C#N

InChI

InChI=1S/C19H25NO3/c1-4-6-7-15(5-2)14-23-19(21)17(13-20)12-16-8-10-18(22-3)11-9-16/h8-12,15H,4-7,14H2,1-3H3/b17-12+