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

Systemtic Name: ethyl 4-[2-oxidanylidene-2-[[(E)-4-phenyl-1-(2-piperidin-1-ylphenyl)but-1-enyl]amino]ethyl]benzoate Openeye Name: ethyl 4-[2-oxo-2-[[(E)-4-phenyl-1-[2-(1-piperidyl)phenyl]but-1-enyl]amino]ethyl]benzoate CAS Name: 4-[2-oxo-2-[[(E)-4-phenyl-1-[2-(1-piperidinyl)phenyl]but-1-enyl]amino]ethyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[2-oxo-2-[[(E)-4-phenyl-1-(2-piperidin-1-ylphenyl)but-1-enyl]amino]ethyl]benzoate Traditional Name: 4-[2-keto-2-[[(E)-4-phenyl-1-(2-piperidinophenyl)but-1-enyl]amino]ethyl]benzoic acid ethyl ester Formula: C32H36N2O3 MolecularWeight: 496.63984

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)CC(=O)NC(=CCCC2=CC=CC=C2)C3=CC=CC=C3N4CCCCC4

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)CC(=O)N/C(=C/CCC2=CC=CC=C2)/C3=CC=CC=C3N4CCCCC4

InChI

InChI=1S/C32H36N2O3/c1-2-37-32(36)27-20-18-26(19-21-27)24-31(35)33-29(16-11-14-25-12-5-3-6-13-25)28-15-7-8-17-30(28)34-22-9-4-10-23-34/h3,5-8,12-13,15-21H,2,4,9-11,14,22-24H2,1H3,(H,33,35)/b29-16+