N-(4-chlorophenyl)-N'-[4-methyl-2-(2-phenylethynyl)phenyl]piperidine-1-carboximidamide

Systemtic Name: N-(4-chlorophenyl)-N'-[4-methyl-2-(2-phenylethynyl)phenyl]piperidine-1-carboximidamide Openeye Name: N-(4-chlorophenyl)-N'-[4-methyl-2-(2-phenylethynyl)phenyl]piperidine-1-carboxamidine CAS Name: N-(4-chlorophenyl)-N'-[4-methyl-2-(2-phenylethynyl)phenyl]-1-piperidinecarboximidamide IUPAC Name: N-(4-chlorophenyl)-N'-[4-methyl-2-(2-phenylethynyl)phenyl]piperidine-1-carboximidamide Traditional Name: N-(4-chlorophenyl)-N'-[4-methyl-2-(2-phenylethynyl)phenyl]piperidine-1-carboxamidine Formula: C27H26ClN3 MolecularWeight: 427.96844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N=C(NC2=CC=C(C=C2)Cl)N3CCCCC3)C#CC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=C(C=C1)N=C(NC2=CC=C(C=C2)Cl)N3CCCCC3)C#CC4=CC=CC=C4

InChI

InChI=1S/C27H26ClN3/c1-21-10-17-26(23(20-21)12-11-22-8-4-2-5-9-22)30-27(31-18-6-3-7-19-31)29-25-15-13-24(28)14-16-25/h2,4-5,8-10,13-17,20H,3,6-7,18-19H2,1H3,(H,29,30)