4-[[4-[2-(2,3,4-trimethoxyphenyl)ethanoyl]piperazin-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[4-[2-(2,3,4-trimethoxyphenyl)ethanoyl]piperazin-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[4-[2-(2,3,4-trimethoxyphenyl)acetyl]piperazin-1-yl]methyl]benzonitrile CAS Name: 4-[[4-[1-oxo-2-(2,3,4-trimethoxyphenyl)ethyl]-1-piperazinyl]methyl]benzonitrile IUPAC Name: 4-[[4-[2-(2,3,4-trimethoxyphenyl)acetyl]piperazin-1-yl]methyl]benzonitrile Traditional Name: 4-[[4-[2-(2,3,4-trimethoxyphenyl)acetyl]piperazino]methyl]benzonitrile Formula: C23H27N3O4 MolecularWeight: 409.47818

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H27N3O4/c1-28-20-9-8-19(22(29-2)23(20)30-3)14-21(27)26-12-10-25(11-13-26)16-18-6-4-17(15-24)5-7-18/h4-9H,10-14,16H2,1-3H3