2-(4-methylpiperazin-1-yl)-2-(4-propoxyphenyl)ethanenitrile

Systemtic Name: 2-(4-methylpiperazin-1-yl)-2-(4-propoxyphenyl)ethanenitrile Openeye Name: 2-(4-methylpiperazin-1-yl)-2-(4-propoxyphenyl)acetonitrile CAS Name: 2-(4-methyl-1-piperazinyl)-2-(4-propoxyphenyl)acetonitrile IUPAC Name: 2-(4-methylpiperazin-1-yl)-2-(4-propoxyphenyl)acetonitrile Traditional Name: 2-(4-methylpiperazino)-2-(4-propoxyphenyl)acetonitrile Formula: C16H23N3O MolecularWeight: 273.37332

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(C#N)N2CCN(CC2)C

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(C#N)N2CCN(CC2)C

InChI

InChI=1S/C16H23N3O/c1-3-12-20-15-6-4-14(5-7-15)16(13-17)19-10-8-18(2)9-11-19/h4-7,16H,3,8-12H2,1-2H3