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

Systemtic Name: 3-[3-[4-(3-methoxyphenyl)carbonyl-3-morpholin-4-ylcarbonyl-piperazin-1-yl]propoxy]benzenecarbonitrile Openeye Name: 3-[3-[4-(3-methoxybenzoyl)-3-(morpholine-4-carbonyl)piperazin-1-yl]propoxy]benzonitrile CAS Name: 3-[3-[4-[(3-methoxyphenyl)-oxomethyl]-3-[4-morpholinyl(oxo)methyl]-1-piperazinyl]propoxy]benzonitrile IUPAC Name: 3-[3-[4-(3-methoxybenzoyl)-3-(morpholine-4-carbonyl)piperazin-1-yl]propoxy]benzonitrile Traditional Name: 3-[3-[4-m-anisoyl-3-(morpholine-4-carbonyl)piperazino]propoxy]benzonitrile Formula: C27H32N4O5 MolecularWeight: 492.56678

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)N2CCN(CC2C(=O)N3CCOCC3)CCCOC4=CC=CC(=C4)C#N

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)N2CCN(CC2C(=O)N3CCOCC3)CCCOC4=CC=CC(=C4)C#N

InChI

InChI=1S/C27H32N4O5/c1-34-23-7-3-6-22(18-23)26(32)31-11-10-29(20-25(31)27(33)30-12-15-35-16-13-30)9-4-14-36-24-8-2-5-21(17-24)19-28/h2-3,5-8,17-18,25H,4,9-16,20H2,1H3