[1-(4-cyclohexylpiperazin-1-yl)-1-oxidanylidene-3-phenyl-propan-2-yl]-methylidyne-azanium

Systemtic Name: [1-(4-cyclohexylpiperazin-1-yl)-1-oxidanylidene-3-phenyl-propan-2-yl]-methylidyne-azanium Openeye Name: [1-benzyl-2-(4-cyclohexylpiperazin-1-yl)-2-oxo-ethyl]-methylidyne-ammonium CAS Name: [1-(4-cyclohexyl-1-piperazinyl)-1-oxo-3-phenylpropan-2-yl]-methylidyneammonium IUPAC Name: [1-(4-cyclohexylpiperazin-1-yl)-1-oxo-3-phenylpropan-2-yl]-methylidyneazanium Traditional Name: [1-benzyl-2-(4-cyclohexylpiperazino)-2-keto-ethyl]-methylidyne-ammonium Formula: C20H28N3O+ MolecularWeight: 326.45582

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Descriptors Computed from Structure

Canonical SMILES:

C#[N+]C(CC1=CC=CC=C1)C(=O)N2CCN(CC2)C3CCCCC3

Isomeric SMILES

C#[N+]C(CC1=CC=CC=C1)C(=O)N2CCN(CC2)C3CCCCC3

InChI

InChI=1S/C20H28N3O/c1-21-19(16-17-8-4-2-5-9-17)20(24)23-14-12-22(13-15-23)18-10-6-3-7-11-18/h1-2,4-5,8-9,18-19H,3,6-7,10-16H2/q+1