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

Systemtic Name: 3-ethoxy-4-[2-(4-methyl-2-phenyl-piperazin-1-yl)-2-oxidanylidene-ethoxy]benzenecarbonitrile Openeye Name: 3-ethoxy-4-[2-(4-methyl-2-phenyl-piperazin-1-yl)-2-oxo-ethoxy]benzonitrile CAS Name: 3-ethoxy-4-[2-(4-methyl-2-phenyl-1-piperazinyl)-2-oxoethoxy]benzonitrile IUPAC Name: 3-ethoxy-4-[2-(4-methyl-2-phenylpiperazin-1-yl)-2-oxoethoxy]benzonitrile Traditional Name: 3-ethoxy-4-[2-keto-2-(4-methyl-2-phenyl-piperazino)ethoxy]benzonitrile Formula: C22H25N3O3 MolecularWeight: 379.4522

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C#N)OCC(=O)N2CCN(CC2C3=CC=CC=C3)C

Isomeric SMILES

CCOC1=C(C=CC(=C1)C#N)OCC(=O)N2CCN(CC2C3=CC=CC=C3)C

InChI

InChI=1S/C22H25N3O3/c1-3-27-21-13-17(14-23)9-10-20(21)28-16-22(26)25-12-11-24(2)15-19(25)18-7-5-4-6-8-18/h4-10,13,19H,3,11-12,15-16H2,1-2H3