1-[4-(phenylmethyl)piperazin-1-yl]heptan-1-one

Systemtic Name: 1-[4-(phenylmethyl)piperazin-1-yl]heptan-1-one Openeye Name: 1-(4-benzylpiperazin-1-yl)heptan-1-one CAS Name: 1-[4-(phenylmethyl)-1-piperazinyl]-1-heptanone IUPAC Name: 1-(4-benzylpiperazin-1-yl)heptan-1-one Traditional Name: 1-(4-benzylpiperazino)heptan-1-one Formula: C18H28N2O MolecularWeight: 288.42772

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)N1CCN(CC1)CC2=CC=CC=C2

Isomeric SMILES

CCCCCCC(=O)N1CCN(CC1)CC2=CC=CC=C2

InChI

InChI=1S/C18H28N2O/c1-2-3-4-8-11-18(21)20-14-12-19(13-15-20)16-17-9-6-5-7-10-17/h5-7,9-10H,2-4,8,11-16H2,1H3