3-[3-(4-ethanoyl-3-morpholin-4-ylcarbonyl-piperazin-1-yl)propoxy]benzenecarbonitrile

Systemtic Name: 3-[3-(4-ethanoyl-3-morpholin-4-ylcarbonyl-piperazin-1-yl)propoxy]benzenecarbonitrile Openeye Name: 3-[3-[4-acetyl-3-(morpholine-4-carbonyl)piperazin-1-yl]propoxy]benzonitrile CAS Name: 3-[3-[4-acetyl-3-[4-morpholinyl(oxo)methyl]-1-piperazinyl]propoxy]benzonitrile IUPAC Name: 3-[3-[4-acetyl-3-(morpholine-4-carbonyl)piperazin-1-yl]propoxy]benzonitrile Traditional Name: 3-[3-[4-acetyl-3-(morpholine-4-carbonyl)piperazino]propoxy]benzonitrile Formula: C21H28N4O4 MolecularWeight: 400.47142

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1C(=O)N2CCOCC2)CCCOC3=CC=CC(=C3)C#N

Isomeric SMILES

CC(=O)N1CCN(CC1C(=O)N2CCOCC2)CCCOC3=CC=CC(=C3)C#N

InChI

InChI=1S/C21H28N4O4/c1-17(26)25-8-7-23(16-20(25)21(27)24-9-12-28-13-10-24)6-3-11-29-19-5-2-4-18(14-19)15-22/h2,4-5,14,20H,3,6-13,16H2,1H3