ethyl 4-[2-oxidanylidene-2-[[(E)-1-(2-piperidin-1-ylphenyl)but-1-enyl]amino]ethyl]benzoate

Systemtic Name: ethyl 4-[2-oxidanylidene-2-[[(E)-1-(2-piperidin-1-ylphenyl)but-1-enyl]amino]ethyl]benzoate Openeye Name: ethyl 4-[2-oxo-2-[[(E)-1-[2-(1-piperidyl)phenyl]but-1-enyl]amino]ethyl]benzoate CAS Name: 4-[2-oxo-2-[[(E)-1-[2-(1-piperidinyl)phenyl]but-1-enyl]amino]ethyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[2-oxo-2-[[(E)-1-(2-piperidin-1-ylphenyl)but-1-enyl]amino]ethyl]benzoate Traditional Name: 4-[2-keto-2-[[(E)-1-(2-piperidinophenyl)but-1-enyl]amino]ethyl]benzoic acid ethyl ester Formula: C26H32N2O3 MolecularWeight: 420.54388

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Descriptors Computed from Structure

Canonical SMILES:

CCC=C(C1=CC=CC=C1N2CCCCC2)NC(=O)CC3=CC=C(C=C3)C(=O)OCC

Isomeric SMILES

CC/C=C(\C1=CC=CC=C1N2CCCCC2)/NC(=O)CC3=CC=C(C=C3)C(=O)OCC

InChI

InChI=1S/C26H32N2O3/c1-3-10-23(22-11-6-7-12-24(22)28-17-8-5-9-18-28)27-25(29)19-20-13-15-21(16-14-20)26(30)31-4-2/h6-7,10-16H,3-5,8-9,17-19H2,1-2H3,(H,27,29)/b23-10+