2-phenyl-2-propan-2-yl-5-[4-(1,2,3,4-tetrahydronaphthalen-2-ylcarbonyl)piperazin-1-yl]pentanenitrile

Systemtic Name: 2-phenyl-2-propan-2-yl-5-[4-(1,2,3,4-tetrahydronaphthalen-2-ylcarbonyl)piperazin-1-yl]pentanenitrile Openeye Name: 2-isopropyl-2-phenyl-5-[4-(tetralin-2-carbonyl)piperazin-1-yl]pentanenitrile CAS Name: 5-[4-[oxo(1,2,3,4-tetrahydronaphthalen-2-yl)methyl]-1-piperazinyl]-2-phenyl-2-propan-2-ylpentanenitrile IUPAC Name: 2-phenyl-2-propan-2-yl-5-[4-(1,2,3,4-tetrahydronaphthalene-2-carbonyl)piperazin-1-yl]pentanenitrile Traditional Name: 2-isopropyl-2-phenyl-5-[4-(tetralin-2-carbonyl)piperazino]valeronitrile Formula: C29H37N3O MolecularWeight: 443.62358

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CCCN1CCN(CC1)C(=O)C2CCC3=CC=CC=C3C2)(C#N)C4=CC=CC=C4

Isomeric SMILES

CC(C)C(CCCN1CCN(CC1)C(=O)C2CCC3=CC=CC=C3C2)(C#N)C4=CC=CC=C4

InChI

InChI=1S/C29H37N3O/c1-23(2)29(22-30,27-11-4-3-5-12-27)15-8-16-31-17-19-32(20-18-31)28(33)26-14-13-24-9-6-7-10-25(24)21-26/h3-7,9-12,23,26H,8,13-21H2,1-2H3