N-[2,6-bis(bromanyl)-4-propan-2-yl-phenyl]-4-cyano-4-phenyl-piperidine-1-carboxamide

Systemtic Name: N-[2,6-bis(bromanyl)-4-propan-2-yl-phenyl]-4-cyano-4-phenyl-piperidine-1-carboxamide Openeye Name: 4-cyano-N-(2,6-dibromo-4-isopropyl-phenyl)-4-phenyl-piperidine-1-carboxamide CAS Name: 4-cyano-N-(2,6-dibromo-4-propan-2-ylphenyl)-4-phenyl-1-piperidinecarboxamide IUPAC Name: 4-cyano-N-(2,6-dibromo-4-propan-2-ylphenyl)-4-phenylpiperidine-1-carboxamide Traditional Name: 4-cyano-N-(2,6-dibromo-4-isopropyl-phenyl)-4-phenyl-piperidine-1-carboxamide Formula: C22H23Br2N3O MolecularWeight: 505.24552

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C(C(=C1)Br)NC(=O)N2CCC(CC2)(C#N)C3=CC=CC=C3)Br

Isomeric SMILES

CC(C)C1=CC(=C(C(=C1)Br)NC(=O)N2CCC(CC2)(C#N)C3=CC=CC=C3)Br

InChI

InChI=1S/C22H23Br2N3O/c1-15(2)16-12-18(23)20(19(24)13-16)26-21(28)27-10-8-22(14-25,9-11-27)17-6-4-3-5-7-17/h3-7,12-13,15H,8-11H2,1-2H3,(H,26,28)