(3-methylphenyl)-[4-(pyridin-4-ylmethyl)piperazin-1-yl]methanone

Systemtic Name: (3-methylphenyl)-[4-(pyridin-4-ylmethyl)piperazin-1-yl]methanone Openeye Name: m-tolyl-[4-(4-pyridylmethyl)piperazin-1-yl]methanone CAS Name: (3-methylphenyl)-[4-(pyridin-4-ylmethyl)-1-piperazinyl]methanone IUPAC Name: (3-methylphenyl)-[4-(pyridin-4-ylmethyl)piperazin-1-yl]methanone Traditional Name: m-tolyl-[4-(4-pyridylmethyl)piperazino]methanone Formula: C18H21N3O MolecularWeight: 295.37884

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)N2CCN(CC2)CC3=CC=NC=C3

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)N2CCN(CC2)CC3=CC=NC=C3

InChI

InChI=1S/C18H21N3O/c1-15-3-2-4-17(13-15)18(22)21-11-9-20(10-12-21)14-16-5-7-19-8-6-16/h2-8,13H,9-12,14H2,1H3