3-[4-(phenylmethyl)piperazin-1-yl]propanal

Systemtic Name: 3-[4-(phenylmethyl)piperazin-1-yl]propanal Openeye Name: 3-(4-benzylpiperazin-1-yl)propanal CAS Name: 3-[4-(phenylmethyl)-1-piperazinyl]propanal IUPAC Name: 3-(4-benzylpiperazin-1-yl)propanal Traditional Name: 3-(4-benzylpiperazino)propionaldehyde Formula: C14H20N2O MolecularWeight: 232.3214

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC=O)CC2=CC=CC=C2

Isomeric SMILES

C1CN(CCN1CCC=O)CC2=CC=CC=C2

InChI

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