2,3-dihydro-1H-pyrrol-2-yl-(4-heptyl-3-pyridin-3-yl-piperazin-1-yl)methanone

Systemtic Name: 2,3-dihydro-1H-pyrrol-2-yl-(4-heptyl-3-pyridin-3-yl-piperazin-1-yl)methanone Openeye Name: 2,3-dihydro-1H-pyrrol-2-yl-[4-heptyl-3-(3-pyridyl)piperazin-1-yl]methanone CAS Name: 2,3-dihydro-1H-pyrrol-2-yl-[4-heptyl-3-(3-pyridinyl)-1-piperazinyl]methanone IUPAC Name: 2,3-dihydro-1H-pyrrol-2-yl-(4-heptyl-3-pyridin-3-ylpiperazin-1-yl)methanone Traditional Name: [4-heptyl-3-(3-pyridyl)piperazino]-(2-pyrrolin-2-yl)methanone Formula: C21H32N4O MolecularWeight: 356.50498

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN1CCN(CC1C2=CN=CC=C2)C(=O)C3CC=CN3

Isomeric SMILES

CCCCCCCN1CCN(CC1C2=CN=CC=C2)C(=O)C3CC=CN3

InChI

InChI=1S/C21H32N4O/c1-2-3-4-5-6-13-24-14-15-25(21(26)19-10-8-12-23-19)17-20(24)18-9-7-11-22-16-18/h7-9,11-12,16,19-20,23H,2-6,10,13-15,17H2,1H3