ethyl 1-[(E)-3-(3-phenylmethoxyphenyl)prop-2-enoyl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-[(E)-3-(3-phenylmethoxyphenyl)prop-2-enoyl]piperidine-3-carboxylate Openeye Name: ethyl 1-[(E)-3-(3-benzyloxyphenyl)prop-2-enoyl]piperidine-3-carboxylate CAS Name: 1-[(E)-1-oxo-3-(3-phenylmethoxyphenyl)prop-2-enyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(E)-3-(3-phenylmethoxyphenyl)prop-2-enoyl]piperidine-3-carboxylate Traditional Name: 1-[(E)-3-(3-benzoxyphenyl)acryloyl]nipecotic acid ethyl ester Formula: C24H27NO4 MolecularWeight: 393.47548

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)C=CC2=CC(=CC=C2)OCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)/C=C/C2=CC(=CC=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C24H27NO4/c1-2-28-24(27)21-11-7-15-25(17-21)23(26)14-13-19-10-6-12-22(16-19)29-18-20-8-4-3-5-9-20/h3-6,8-10,12-14,16,21H,2,7,11,15,17-18H2,1H3/b14-13+