2-fluoranyl-6-[4-(1,2,3,4-tetrahydronaphthalen-1-ylcarbonyl)piperazin-1-yl]benzenecarbonitrile

Systemtic Name: 2-fluoranyl-6-[4-(1,2,3,4-tetrahydronaphthalen-1-ylcarbonyl)piperazin-1-yl]benzenecarbonitrile Openeye Name: 2-fluoro-6-[4-(tetralin-1-carbonyl)piperazin-1-yl]benzonitrile CAS Name: 2-fluoro-6-[4-[oxo(1,2,3,4-tetrahydronaphthalen-1-yl)methyl]-1-piperazinyl]benzonitrile IUPAC Name: 2-fluoro-6-[4-(1,2,3,4-tetrahydronaphthalene-1-carbonyl)piperazin-1-yl]benzonitrile Traditional Name: 2-fluoro-6-[4-(tetralin-1-carbonyl)piperazino]benzonitrile Formula: C22H22FN3O MolecularWeight: 363.427983

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C2=CC=CC=C2C1)C(=O)N3CCN(CC3)C4=C(C(=CC=C4)F)C#N

Isomeric SMILES

C1CC(C2=CC=CC=C2C1)C(=O)N3CCN(CC3)C4=C(C(=CC=C4)F)C#N

InChI

InChI=1S/C22H22FN3O/c23-20-9-4-10-21(19(20)15-24)25-11-13-26(14-12-25)22(27)18-8-3-6-16-5-1-2-7-17(16)18/h1-2,4-5,7,9-10,18H,3,6,8,11-14H2