4-[[4-[3-(3,4-dimethoxyphenyl)propanoyl]piperazin-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[4-[3-(3,4-dimethoxyphenyl)propanoyl]piperazin-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[4-[3-(3,4-dimethoxyphenyl)propanoyl]piperazin-1-yl]methyl]benzonitrile CAS Name: 4-[[4-[3-(3,4-dimethoxyphenyl)-1-oxopropyl]-1-piperazinyl]methyl]benzonitrile IUPAC Name: 4-[[4-[3-(3,4-dimethoxyphenyl)propanoyl]piperazin-1-yl]methyl]benzonitrile Traditional Name: 4-[[4-[3-(3,4-dimethoxyphenyl)propanoyl]piperazino]methyl]benzonitrile Formula: C23H27N3O3 MolecularWeight: 393.47878

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H27N3O3/c1-28-21-9-7-18(15-22(21)29-2)8-10-23(27)26-13-11-25(12-14-26)17-20-5-3-19(16-24)4-6-20/h3-7,9,15H,8,10-14,17H2,1-2H3