1-(azepan-1-yl)-2-(4-pyridin-2-ylpiperazin-1-yl)butan-1-one

Systemtic Name: 1-(azepan-1-yl)-2-(4-pyridin-2-ylpiperazin-1-yl)butan-1-one Openeye Name: 1-(azepan-1-yl)-2-[4-(2-pyridyl)piperazin-1-yl]butan-1-one CAS Name: 1-(1-azepanyl)-2-[4-(2-pyridinyl)-1-piperazinyl]-1-butanone IUPAC Name: 1-(azepan-1-yl)-2-(4-pyridin-2-ylpiperazin-1-yl)butan-1-one Traditional Name: 1-(azepan-1-yl)-2-[4-(2-pyridyl)piperazino]butan-1-one Formula: C19H30N4O MolecularWeight: 330.4677

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N1CCCCCC1)N2CCN(CC2)C3=CC=CC=N3

Isomeric SMILES

CCC(C(=O)N1CCCCCC1)N2CCN(CC2)C3=CC=CC=N3

InChI

InChI=1S/C19H30N4O/c1-2-17(19(24)23-11-7-3-4-8-12-23)21-13-15-22(16-14-21)18-9-5-6-10-20-18/h5-6,9-10,17H,2-4,7-8,11-16H2,1H3