4-[[4-[(E)-3-(2,4-dimethoxyphenyl)prop-2-enoyl]piperazin-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[4-[(E)-3-(2,4-dimethoxyphenyl)prop-2-enoyl]piperazin-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[4-[(E)-3-(2,4-dimethoxyphenyl)prop-2-enoyl]piperazin-1-yl]methyl]benzonitrile CAS Name: 4-[[4-[(E)-3-(2,4-dimethoxyphenyl)-1-oxoprop-2-enyl]-1-piperazinyl]methyl]benzonitrile IUPAC Name: 4-[[4-[(E)-3-(2,4-dimethoxyphenyl)prop-2-enoyl]piperazin-1-yl]methyl]benzonitrile Traditional Name: 4-[[4-[(E)-3-(2,4-dimethoxyphenyl)acryloyl]piperazino]methyl]benzonitrile Formula: C23H25N3O3 MolecularWeight: 391.4629

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C=CC(=O)N2CCN(CC2)CC3=CC=C(C=C3)C#N)OC

Isomeric SMILES

COC1=CC(=C(C=C1)/C=C/C(=O)N2CCN(CC2)CC3=CC=C(C=C3)C#N)OC

InChI

InChI=1S/C23H25N3O3/c1-28-21-9-7-20(22(15-21)29-2)8-10-23(27)26-13-11-25(12-14-26)17-19-5-3-18(16-24)4-6-19/h3-10,15H,11-14,17H2,1-2H3/b10-8+