4-(3-phenylpropyl)piperazin-4-ium-1-carbaldehyde

Systemtic Name: 4-(3-phenylpropyl)piperazin-4-ium-1-carbaldehyde Openeye Name: 4-(3-phenylpropyl)piperazin-4-ium-1-carbaldehyde CAS Name: 4-(3-phenylpropyl)-1-piperazin-4-iumcarboxaldehyde IUPAC Name: 4-(3-phenylpropyl)piperazin-4-ium-1-carbaldehyde Traditional Name: 4-(3-phenylpropyl)piperazin-4-ium-1-carbaldehyde Formula: C14H21N2O+ MolecularWeight: 233.32934

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCCC2=CC=CC=C2)C=O

Isomeric SMILES

C1CN(CC[NH+]1CCCC2=CC=CC=C2)C=O

InChI

InChI=1S/C14H20N2O/c17-13-16-11-9-15(10-12-16)8-4-7-14-5-2-1-3-6-14/h1-3,5-6,13H,4,7-12H2/p+1