2-ethyl-1-[4-[(3-methylphenyl)methyl]piperazin-1-yl]butan-1-one

Systemtic Name: 2-ethyl-1-[4-[(3-methylphenyl)methyl]piperazin-1-yl]butan-1-one Openeye Name: 2-ethyl-1-[4-(m-tolylmethyl)piperazin-1-yl]butan-1-one CAS Name: 2-ethyl-1-[4-[(3-methylphenyl)methyl]-1-piperazinyl]-1-butanone IUPAC Name: 2-ethyl-1-[4-[(3-methylphenyl)methyl]piperazin-1-yl]butan-1-one Traditional Name: 2-ethyl-1-[4-(3-methylbenzyl)piperazino]butan-1-one Formula: C18H28N2O MolecularWeight: 288.42772

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H28N2O/c1-4-17(5-2)18(21)20-11-9-19(10-12-20)14-16-8-6-7-15(3)13-16/h6-8,13,17H,4-5,9-12,14H2,1-3H3