6-methylheptyl (Z)-2-cyano-3-(4-methoxyphenyl)prop-2-enoate

Systemtic Name: 6-methylheptyl (Z)-2-cyano-3-(4-methoxyphenyl)prop-2-enoate Openeye Name: 6-methylheptyl (Z)-2-cyano-3-(4-methoxyphenyl)prop-2-enoate CAS Name: (Z)-2-cyano-3-(4-methoxyphenyl)-2-propenoic acid 6-methylheptyl ester IUPAC Name: 6-methylheptyl (Z)-2-cyano-3-(4-methoxyphenyl)prop-2-enoate Traditional Name: (Z)-2-cyano-3-(4-methoxyphenyl)acrylic acid 6-methylheptyl ester Formula: C19H25NO3 MolecularWeight: 315.4067

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCOC(=O)C(=CC1=CC=C(C=C1)OC)C#N

Isomeric SMILES

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

InChI

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