4-[[2,6-bis(chloranyl)phenyl]methyl]piperazin-4-ium-1-carbaldehyde

Systemtic Name: 4-[[2,6-bis(chloranyl)phenyl]methyl]piperazin-4-ium-1-carbaldehyde Openeye Name: 4-[(2,6-dichlorophenyl)methyl]piperazin-4-ium-1-carbaldehyde CAS Name: 4-[(2,6-dichlorophenyl)methyl]-1-piperazin-4-iumcarboxaldehyde IUPAC Name: 4-[(2,6-dichlorophenyl)methyl]piperazin-4-ium-1-carbaldehyde Traditional Name: 4-(2,6-dichlorobenzyl)piperazin-4-ium-1-carbaldehyde Formula: C12H15Cl2N2O+ MolecularWeight: 274.1663

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=C(C=CC=C2Cl)Cl)C=O

Isomeric SMILES

C1CN(CC[NH+]1CC2=C(C=CC=C2Cl)Cl)C=O

InChI

InChI=1S/C12H14Cl2N2O/c13-11-2-1-3-12(14)10(11)8-15-4-6-16(9-17)7-5-15/h1-3,9H,4-8H2/p+1