3-[4-(4-methoxyphenyl)piperazin-1-yl]-2,2-dimethyl-3-oxidanylidene-propanenitrile

Systemtic Name: 3-[4-(4-methoxyphenyl)piperazin-1-yl]-2,2-dimethyl-3-oxidanylidene-propanenitrile Openeye Name: 3-[4-(4-methoxyphenyl)piperazin-1-yl]-2,2-dimethyl-3-oxo-propanenitrile CAS Name: 3-[4-(4-methoxyphenyl)-1-piperazinyl]-2,2-dimethyl-3-oxopropanenitrile IUPAC Name: 3-[4-(4-methoxyphenyl)piperazin-1-yl]-2,2-dimethyl-3-oxopropanenitrile Traditional Name: 3-keto-3-[4-(4-methoxyphenyl)piperazino]-2,2-dimethyl-propionitrile Formula: C16H21N3O2 MolecularWeight: 287.35684

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#N)C(=O)N1CCN(CC1)C2=CC=C(C=C2)OC

Isomeric SMILES

CC(C)(C#N)C(=O)N1CCN(CC1)C2=CC=C(C=C2)OC

InChI

InChI=1S/C16H21N3O2/c1-16(2,12-17)15(20)19-10-8-18(9-11-19)13-4-6-14(21-3)7-5-13/h4-7H,8-11H2,1-3H3