(1-ethoxy-2-methyl-1-oxidanylidene-propan-2-yl) (E)-2-cyano-3-phenyl-prop-2-enoate

Systemtic Name: (1-ethoxy-2-methyl-1-oxidanylidene-propan-2-yl) (E)-2-cyano-3-phenyl-prop-2-enoate Openeye Name: (2-ethoxy-1,1-dimethyl-2-oxo-ethyl) (E)-2-cyano-3-phenyl-prop-2-enoate CAS Name: (E)-2-cyano-3-phenyl-2-propenoic acid (1-ethoxy-2-methyl-1-oxopropan-2-yl) ester IUPAC Name: (1-ethoxy-2-methyl-1-oxopropan-2-yl) (E)-2-cyano-3-phenylprop-2-enoate Traditional Name: (E)-2-cyano-3-phenyl-acrylic acid (2-ethoxy-2-keto-1,1-dimethyl-ethyl) ester Formula: C16H17NO4 MolecularWeight: 287.31048

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCOC(=O)C(C)(C)OC(=O)/C(=C/C1=CC=CC=C1)/C#N

InChI

InChI=1S/C16H17NO4/c1-4-20-15(19)16(2,3)21-14(18)13(11-17)10-12-8-6-5-7-9-12/h5-10H,4H2,1-3H3/b13-10+