N-(3-imidazol-1-ylpropyl)-4-[2-(1-oxidanylcyclohexyl)ethynyl]benzamide

Systemtic Name: N-(3-imidazol-1-ylpropyl)-4-[2-(1-oxidanylcyclohexyl)ethynyl]benzamide Openeye Name: 4-[2-(1-hydroxycyclohexyl)ethynyl]-N-(3-imidazol-1-ylpropyl)benzamide CAS Name: 4-[2-(1-hydroxycyclohexyl)ethynyl]-N-[3-(1-imidazolyl)propyl]benzamide IUPAC Name: 4-[2-(1-hydroxycyclohexyl)ethynyl]-N-(3-imidazol-1-ylpropyl)benzamide Traditional Name: 4-[2-(1-hydroxycyclohexyl)ethynyl]-N-(3-imidazol-1-ylpropyl)benzamide Formula: C21H25N3O2 MolecularWeight: 351.4421

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(C#CC2=CC=C(C=C2)C(=O)NCCCN3C=CN=C3)O

Isomeric SMILES

C1CCC(CC1)(C#CC2=CC=C(C=C2)C(=O)NCCCN3C=CN=C3)O

InChI

InChI=1S/C21H25N3O2/c25-20(23-13-4-15-24-16-14-22-17-24)19-7-5-18(6-8-19)9-12-21(26)10-2-1-3-11-21/h5-8,14,16-17,26H,1-4,10-11,13,15H2,(H,23,25)