6-methylheptyl (Z)-3-(2-cyanophenyl)-3-phenyl-prop-2-enoate

Systemtic Name: 6-methylheptyl (Z)-3-(2-cyanophenyl)-3-phenyl-prop-2-enoate Openeye Name: 6-methylheptyl (Z)-3-(2-cyanophenyl)-3-phenyl-prop-2-enoate CAS Name: (Z)-3-(2-cyanophenyl)-3-phenyl-2-propenoic acid 6-methylheptyl ester IUPAC Name: 6-methylheptyl (Z)-3-(2-cyanophenyl)-3-phenylprop-2-enoate Traditional Name: (Z)-3-(2-cyanophenyl)-3-phenyl-acrylic acid 6-methylheptyl ester Formula: C24H27NO2 MolecularWeight: 361.47668

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCOC(=O)C=C(C1=CC=CC=C1)C2=CC=CC=C2C#N

Isomeric SMILES

CC(C)CCCCCOC(=O)/C=C(/C1=CC=CC=C1)\C2=CC=CC=C2C#N

InChI

InChI=1S/C24H27NO2/c1-19(2)11-5-4-10-16-27-24(26)17-23(20-12-6-3-7-13-20)22-15-9-8-14-21(22)18-25/h3,6-9,12-15,17,19H,4-5,10-11,16H2,1-2H3/b23-17-