2-[4-(3,5-dimethoxyphenyl)carbonylpiperazin-1-yl]ethanenitrile

Systemtic Name: 2-[4-(3,5-dimethoxyphenyl)carbonylpiperazin-1-yl]ethanenitrile Openeye Name: 2-[4-(3,5-dimethoxybenzoyl)piperazin-1-yl]acetonitrile CAS Name: 2-[4-[(3,5-dimethoxyphenyl)-oxomethyl]-1-piperazinyl]acetonitrile IUPAC Name: 2-[4-(3,5-dimethoxybenzoyl)piperazin-1-yl]acetonitrile Traditional Name: 2-[4-(3,5-dimethoxybenzoyl)piperazino]acetonitrile Formula: C15H19N3O3 MolecularWeight: 289.32966

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19N3O3/c1-20-13-9-12(10-14(11-13)21-2)15(19)18-7-5-17(4-3-16)6-8-18/h9-11H,4-8H2,1-2H3