3,3-dimethyl-1-[4-(pyridin-4-ylmethyl)piperazin-1-yl]butan-1-one

Systemtic Name: 3,3-dimethyl-1-[4-(pyridin-4-ylmethyl)piperazin-1-yl]butan-1-one Openeye Name: 3,3-dimethyl-1-[4-(4-pyridylmethyl)piperazin-1-yl]butan-1-one CAS Name: 3,3-dimethyl-1-[4-(pyridin-4-ylmethyl)-1-piperazinyl]-1-butanone IUPAC Name: 3,3-dimethyl-1-[4-(pyridin-4-ylmethyl)piperazin-1-yl]butan-1-one Traditional Name: 3,3-dimethyl-1-[4-(4-pyridylmethyl)piperazino]butan-1-one Formula: C16H25N3O MolecularWeight: 275.3892

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H25N3O/c1-16(2,3)12-15(20)19-10-8-18(9-11-19)13-14-4-6-17-7-5-14/h4-7H,8-13H2,1-3H3