4-[[4-(diethylamino)phenyl]methyl]piperazin-4-ium-1-carbaldehyde

Systemtic Name: 4-[[4-(diethylamino)phenyl]methyl]piperazin-4-ium-1-carbaldehyde Openeye Name: 4-[[4-(diethylamino)phenyl]methyl]piperazin-4-ium-1-carbaldehyde CAS Name: 4-[[4-(diethylamino)phenyl]methyl]-1-piperazin-4-iumcarboxaldehyde IUPAC Name: 4-[[4-(diethylamino)phenyl]methyl]piperazin-4-ium-1-carbaldehyde Traditional Name: 4-[4-(diethylamino)benzyl]piperazin-4-ium-1-carbaldehyde Formula: C16H26N3O+ MolecularWeight: 276.39714

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)C[NH+]2CCN(CC2)C=O

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)C[NH+]2CCN(CC2)C=O

InChI

InChI=1S/C16H25N3O/c1-3-19(4-2)16-7-5-15(6-8-16)13-17-9-11-18(14-20)12-10-17/h5-8,14H,3-4,9-13H2,1-2H3/p+1