(3,3-dimethyl-2-oxidanylidene-butyl) (E)-3-(4-cyanophenyl)prop-2-enoate

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-butyl) (E)-3-(4-cyanophenyl)prop-2-enoate Openeye Name: (3,3-dimethyl-2-oxo-butyl) (E)-3-(4-cyanophenyl)prop-2-enoate CAS Name: (E)-3-(4-cyanophenyl)-2-propenoic acid (3,3-dimethyl-2-oxobutyl) ester IUPAC Name: (3,3-dimethyl-2-oxobutyl) (E)-3-(4-cyanophenyl)prop-2-enoate Traditional Name: (E)-3-(4-cyanophenyl)acrylic acid (2-keto-3,3-dimethyl-butyl) ester Formula: C16H17NO3 MolecularWeight: 271.31108

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17NO3/c1-16(2,3)14(18)11-20-15(19)9-8-12-4-6-13(10-17)7-5-12/h4-9H,11H2,1-3H3/b9-8+