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

Systemtic Name: ethyl 4-[2-oxidanylidene-2-[[(E)-1-(2-piperidin-1-ylphenyl)hex-1-enyl]amino]ethyl]benzoate Openeye Name: ethyl 4-[2-oxo-2-[[(E)-1-[2-(1-piperidyl)phenyl]hex-1-enyl]amino]ethyl]benzoate CAS Name: 4-[2-oxo-2-[[(E)-1-[2-(1-piperidinyl)phenyl]hex-1-enyl]amino]ethyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[2-oxo-2-[[(E)-1-(2-piperidin-1-ylphenyl)hex-1-enyl]amino]ethyl]benzoate Traditional Name: 4-[2-keto-2-[[(E)-1-(2-piperidinophenyl)hex-1-enyl]amino]ethyl]benzoic acid ethyl ester Formula: C28H36N2O3 MolecularWeight: 448.59704

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H36N2O3/c1-3-5-7-13-25(24-12-8-9-14-26(24)30-19-10-6-11-20-30)29-27(31)21-22-15-17-23(18-16-22)28(32)33-4-2/h8-9,12-18H,3-7,10-11,19-21H2,1-2H3,(H,29,31)/b25-13+