N-(1,3-benzodioxol-5-ylmethyl)-4-[2-(1-oxidanylcyclohexyl)ethynyl]benzamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-4-[2-(1-oxidanylcyclohexyl)ethynyl]benzamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-4-[2-(1-hydroxycyclohexyl)ethynyl]benzamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-4-[2-(1-hydroxycyclohexyl)ethynyl]benzamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-4-[2-(1-hydroxycyclohexyl)ethynyl]benzamide Traditional Name: 4-[2-(1-hydroxycyclohexyl)ethynyl]-N-piperonyl-benzamide Formula: C23H23NO4 MolecularWeight: 377.43302

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(C#CC2=CC=C(C=C2)C(=O)NCC3=CC4=C(C=C3)OCO4)O

Isomeric SMILES

C1CCC(CC1)(C#CC2=CC=C(C=C2)C(=O)NCC3=CC4=C(C=C3)OCO4)O

InChI

InChI=1S/C23H23NO4/c25-22(24-15-18-6-9-20-21(14-18)28-16-27-20)19-7-4-17(5-8-19)10-13-23(26)11-2-1-3-12-23/h4-9,14,26H,1-3,11-12,15-16H2,(H,24,25)