2-ethyl-1-[4-(phenylmethyl)piperazin-1-yl]hexan-1-one

Systemtic Name: 2-ethyl-1-[4-(phenylmethyl)piperazin-1-yl]hexan-1-one Openeye Name: 1-(4-benzylpiperazin-1-yl)-2-ethyl-hexan-1-one CAS Name: 2-ethyl-1-[4-(phenylmethyl)-1-piperazinyl]-1-hexanone IUPAC Name: 1-(4-benzylpiperazin-1-yl)-2-ethylhexan-1-one Traditional Name: 1-(4-benzylpiperazino)-2-ethyl-hexan-1-one Formula: C19H30N2O MolecularWeight: 302.4543

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)N1CCN(CC1)CC2=CC=CC=C2

Isomeric SMILES

CCCCC(CC)C(=O)N1CCN(CC1)CC2=CC=CC=C2

InChI

InChI=1S/C19H30N2O/c1-3-5-11-18(4-2)19(22)21-14-12-20(13-15-21)16-17-9-7-6-8-10-17/h6-10,18H,3-5,11-16H2,1-2H3