4-[3-[[2-(4-methoxyphenyl)-2-morpholin-4-yl-ethyl]amino]-2-oxidanyl-propoxy]benzenecarbonitrile

Systemtic Name: 4-[3-[[2-(4-methoxyphenyl)-2-morpholin-4-yl-ethyl]amino]-2-oxidanyl-propoxy]benzenecarbonitrile Openeye Name: 4-[2-hydroxy-3-[[2-(4-methoxyphenyl)-2-morpholino-ethyl]amino]propoxy]benzonitrile CAS Name: 4-[2-hydroxy-3-[[2-(4-methoxyphenyl)-2-(4-morpholinyl)ethyl]amino]propoxy]benzonitrile IUPAC Name: 4-[2-hydroxy-3-[[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]amino]propoxy]benzonitrile Traditional Name: 4-[2-hydroxy-3-[[2-(4-methoxyphenyl)-2-morpholino-ethyl]amino]propoxy]benzonitrile Formula: C23H29N3O4 MolecularWeight: 411.49406

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CNCC(COC2=CC=C(C=C2)C#N)O)N3CCOCC3

Isomeric SMILES

COC1=CC=C(C=C1)C(CNCC(COC2=CC=C(C=C2)C#N)O)N3CCOCC3

InChI

InChI=1S/C23H29N3O4/c1-28-21-8-4-19(5-9-21)23(26-10-12-29-13-11-26)16-25-15-20(27)17-30-22-6-2-18(14-24)3-7-22/h2-9,20,23,25,27H,10-13,15-17H2,1H3