ethyl 1-[2-[(E)-2-cyano-3-(4-propan-2-ylphenyl)prop-2-enoyl]oxyethanoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-[(E)-2-cyano-3-(4-propan-2-ylphenyl)prop-2-enoyl]oxyethanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-[(E)-2-cyano-3-(4-isopropylphenyl)prop-2-enoyl]oxyacetyl]piperidine-4-carboxylate CAS Name: 1-[2-[(E)-2-cyano-1-oxo-3-(4-propan-2-ylphenyl)prop-2-enoxy]-1-oxoethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-[(E)-2-cyano-3-(4-propan-2-ylphenyl)prop-2-enoyl]oxyacetyl]piperidine-4-carboxylate Traditional Name: 1-[2-[(E)-2-cyano-3-p-cumenyl-acryloyl]oxyacetyl]isonipecotic acid ethyl ester Formula: C23H28N2O5 MolecularWeight: 412.47882

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)COC(=O)C(=CC2=CC=C(C=C2)C(C)C)C#N

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)COC(=O)/C(=C/C2=CC=C(C=C2)C(C)C)/C#N

InChI

InChI=1S/C23H28N2O5/c1-4-29-22(27)19-9-11-25(12-10-19)21(26)15-30-23(28)20(14-24)13-17-5-7-18(8-6-17)16(2)3/h5-8,13,16,19H,4,9-12,15H2,1-3H3/b20-13+