4-phenyloctan-3-yl (Z)-3-cyano-3-phenyl-prop-2-enoate

Systemtic Name: 4-phenyloctan-3-yl (Z)-3-cyano-3-phenyl-prop-2-enoate Openeye Name: (1-ethyl-2-phenyl-hexyl) (Z)-3-cyano-3-phenyl-prop-2-enoate CAS Name: (Z)-3-cyano-3-phenyl-2-propenoic acid 4-phenyloctan-3-yl ester IUPAC Name: 4-phenyloctan-3-yl (Z)-3-cyano-3-phenylprop-2-enoate Traditional Name: (Z)-3-cyano-3-phenyl-acrylic acid (1-ethyl-2-phenyl-hexyl) ester Formula: C24H27NO2 MolecularWeight: 361.47668

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C1=CC=CC=C1)C(CC)OC(=O)C=C(C#N)C2=CC=CC=C2

Isomeric SMILES

CCCCC(C1=CC=CC=C1)C(CC)OC(=O)/C=C(\C#N)/C2=CC=CC=C2

InChI

InChI=1S/C24H27NO2/c1-3-5-16-22(20-14-10-7-11-15-20)23(4-2)27-24(26)17-21(18-25)19-12-8-6-9-13-19/h6-15,17,22-23H,3-5,16H2,1-2H3/b21-17+