(4-tert-butyl-2,6-dimethyl-phenyl)methyl (E)-2-cyano-3-(4-dimethylaminophenyl)prop-2-enoate

Systemtic Name: (4-tert-butyl-2,6-dimethyl-phenyl)methyl (E)-2-cyano-3-(4-dimethylaminophenyl)prop-2-enoate Openeye Name: (4-tert-butyl-2,6-dimethyl-phenyl)methyl (E)-2-cyano-3-(4-dimethylaminophenyl)prop-2-enoate CAS Name: (E)-2-cyano-3-(4-dimethylaminophenyl)-2-propenoic acid (4-tert-butyl-2,6-dimethylphenyl)methyl ester IUPAC Name: (4-tert-butyl-2,6-dimethylphenyl)methyl (E)-2-cyano-3-(4-dimethylaminophenyl)prop-2-enoate Traditional Name: (E)-2-cyano-3-(4-dimethylaminophenyl)acrylic acid (4-tert-butyl-2,6-dimethyl-benzyl) ester Formula: C25H30N2O2 MolecularWeight: 390.5179

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1COC(=O)C(=CC2=CC=C(C=C2)N(C)C)C#N)C)C(C)(C)C

Isomeric SMILES

CC1=CC(=CC(=C1COC(=O)/C(=C/C2=CC=C(C=C2)N(C)C)/C#N)C)C(C)(C)C

InChI

InChI=1S/C25H30N2O2/c1-17-12-21(25(3,4)5)13-18(2)23(17)16-29-24(28)20(15-26)14-19-8-10-22(11-9-19)27(6)7/h8-14H,16H2,1-7H3/b20-14+