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

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-butyl) (E)-2-cyano-3-(4-dimethylaminophenyl)prop-2-enoate Openeye Name: (3,3-dimethyl-2-oxo-butyl) (E)-2-cyano-3-(4-dimethylaminophenyl)prop-2-enoate CAS Name: (E)-2-cyano-3-(4-dimethylaminophenyl)-2-propenoic acid (3,3-dimethyl-2-oxobutyl) ester IUPAC Name: (3,3-dimethyl-2-oxobutyl) (E)-2-cyano-3-(4-dimethylaminophenyl)prop-2-enoate Traditional Name: (E)-2-cyano-3-(4-dimethylaminophenyl)acrylic acid (2-keto-3,3-dimethyl-butyl) ester Formula: C18H22N2O3 MolecularWeight: 314.37888

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22N2O3/c1-18(2,3)16(21)12-23-17(22)14(11-19)10-13-6-8-15(9-7-13)20(4)5/h6-10H,12H2,1-5H3/b14-10+