ethyl 3-[[4-(4-pyridin-4-ylpiperazin-1-yl)phenyl]carbonylamino]butanoate

Systemtic Name: ethyl 3-[[4-(4-pyridin-4-ylpiperazin-1-yl)phenyl]carbonylamino]butanoate Openeye Name: ethyl 3-[[4-[4-(4-pyridyl)piperazin-1-yl]benzoyl]amino]butanoate CAS Name: 3-[[oxo-[4-(4-pyridin-4-yl-1-piperazinyl)phenyl]methyl]amino]butanoic acid ethyl ester IUPAC Name: ethyl 3-[[4-(4-pyridin-4-ylpiperazin-1-yl)benzoyl]amino]butanoate Traditional Name: 3-[[4-[4-(4-pyridyl)piperazino]benzoyl]amino]butyric acid ethyl ester Formula: C22H28N4O3 MolecularWeight: 396.48272

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C)NC(=O)C1=CC=C(C=C1)N2CCN(CC2)C3=CC=NC=C3

Isomeric SMILES

CCOC(=O)CC(C)NC(=O)C1=CC=C(C=C1)N2CCN(CC2)C3=CC=NC=C3

InChI

InChI=1S/C22H28N4O3/c1-3-29-21(27)16-17(2)24-22(28)18-4-6-19(7-5-18)25-12-14-26(15-13-25)20-8-10-23-11-9-20/h4-11,17H,3,12-16H2,1-2H3,(H,24,28)