ethyl 1-[2-[(E)-3-(3,5-dimethoxyphenyl)prop-2-enoyl]oxyethanoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-[(E)-3-(3,5-dimethoxyphenyl)prop-2-enoyl]oxyethanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-[(E)-3-(3,5-dimethoxyphenyl)prop-2-enoyl]oxyacetyl]piperidine-4-carboxylate CAS Name: 1-[2-[(E)-3-(3,5-dimethoxyphenyl)-1-oxoprop-2-enoxy]-1-oxoethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-[(E)-3-(3,5-dimethoxyphenyl)prop-2-enoyl]oxyacetyl]piperidine-4-carboxylate Traditional Name: 1-[2-[(E)-3-(3,5-dimethoxyphenyl)acryloyl]oxyacetyl]isonipecotic acid ethyl ester Formula: C21H27NO7 MolecularWeight: 405.44158

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27NO7/c1-4-28-21(25)16-7-9-22(10-8-16)19(23)14-29-20(24)6-5-15-11-17(26-2)13-18(12-15)27-3/h5-6,11-13,16H,4,7-10,14H2,1-3H3/b6-5+