3-ethoxy-4-[2-oxidanylidene-2-[4-(1-phenylethyl)piperazin-1-yl]ethoxy]benzenecarbonitrile

Systemtic Name: 3-ethoxy-4-[2-oxidanylidene-2-[4-(1-phenylethyl)piperazin-1-yl]ethoxy]benzenecarbonitrile Openeye Name: 3-ethoxy-4-[2-oxo-2-[4-(1-phenylethyl)piperazin-1-yl]ethoxy]benzonitrile CAS Name: 3-ethoxy-4-[2-oxo-2-[4-(1-phenylethyl)-1-piperazinyl]ethoxy]benzonitrile IUPAC Name: 3-ethoxy-4-[2-oxo-2-[4-(1-phenylethyl)piperazin-1-yl]ethoxy]benzonitrile Traditional Name: 3-ethoxy-4-[2-keto-2-[4-(1-phenylethyl)piperazino]ethoxy]benzonitrile Formula: C23H27N3O3 MolecularWeight: 393.47878

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C#N)OCC(=O)N2CCN(CC2)C(C)C3=CC=CC=C3

Isomeric SMILES

CCOC1=C(C=CC(=C1)C#N)OCC(=O)N2CCN(CC2)C(C)C3=CC=CC=C3

InChI

InChI=1S/C23H27N3O3/c1-3-28-22-15-19(16-24)9-10-21(22)29-17-23(27)26-13-11-25(12-14-26)18(2)20-7-5-4-6-8-20/h4-10,15,18H,3,11-14,17H2,1-2H3