ethyl 4-[2-[[3-(butanoylamino)phenyl]carbonylamino]phenyl]carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-[[3-(butanoylamino)phenyl]carbonylamino]phenyl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[2-[[3-(butanoylamino)benzoyl]amino]benzoyl]piperazine-1-carboxylate CAS Name: 4-[oxo-[2-[[oxo-[3-(1-oxobutylamino)phenyl]methyl]amino]phenyl]methyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[[3-(butanoylamino)benzoyl]amino]benzoyl]piperazine-1-carboxylate Traditional Name: 4-[2-[(3-butyramidobenzoyl)amino]benzoyl]piperazine-1-carboxylic acid ethyl ester Formula: C25H30N4O5 MolecularWeight: 466.5295

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC=CC(=C1)C(=O)NC2=CC=CC=C2C(=O)N3CCN(CC3)C(=O)OCC

Isomeric SMILES

CCCC(=O)NC1=CC=CC(=C1)C(=O)NC2=CC=CC=C2C(=O)N3CCN(CC3)C(=O)OCC

InChI

InChI=1S/C25H30N4O5/c1-3-8-22(30)26-19-10-7-9-18(17-19)23(31)27-21-12-6-5-11-20(21)24(32)28-13-15-29(16-14-28)25(33)34-4-2/h5-7,9-12,17H,3-4,8,13-16H2,1-2H3,(H,26,30)(H,27,31)