5-[4-(4-isocyano-5-methyl-4-phenyl-hexyl)piperazin-1-yl]-2-phenyl-2-propan-2-yl-pentanenitrile

Systemtic Name: 5-[4-(4-isocyano-5-methyl-4-phenyl-hexyl)piperazin-1-yl]-2-phenyl-2-propan-2-yl-pentanenitrile Openeye Name: 5-[4-(4-isocyano-5-methyl-4-phenyl-hexyl)piperazin-1-yl]-2-isopropyl-2-phenyl-pentanenitrile CAS Name: 5-[4-(4-isocyano-5-methyl-4-phenylhexyl)-1-piperazinyl]-2-phenyl-2-propan-2-ylpentanenitrile IUPAC Name: 5-[4-(4-isocyano-5-methyl-4-phenylhexyl)piperazin-1-yl]-2-phenyl-2-propan-2-ylpentanenitrile Traditional Name: 5-[4-(4-isocyano-5-methyl-4-phenyl-hexyl)piperazino]-2-isopropyl-2-phenyl-valeronitrile Formula: C32H44N4 MolecularWeight: 484.71856

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CCCN1CCN(CC1)CCCC(C2=CC=CC=C2)(C(C)C)[N+]#[C-])(C#N)C3=CC=CC=C3

Isomeric SMILES

CC(C)C(CCCN1CCN(CC1)CCCC(C2=CC=CC=C2)(C(C)C)[N+]#[C-])(C#N)C3=CC=CC=C3

InChI

InChI=1S/C32H44N4/c1-27(2)31(26-33,29-14-8-6-9-15-29)18-12-20-35-22-24-36(25-23-35)21-13-19-32(34-5,28(3)4)30-16-10-7-11-17-30/h6-11,14-17,27-28H,12-13,18-25H2,1-4H3