N-(1,3-benzodioxol-5-ylmethyl)-4-(3-methyl-3-oxidanyl-but-1-ynyl)benzamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-4-(3-methyl-3-oxidanyl-but-1-ynyl)benzamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-4-(3-hydroxy-3-methyl-but-1-ynyl)benzamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-4-(3-hydroxy-3-methylbut-1-ynyl)benzamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-4-(3-hydroxy-3-methylbut-1-ynyl)benzamide Traditional Name: 4-(3-hydroxy-3-methyl-but-1-ynyl)-N-piperonyl-benzamide Formula: C20H19NO4 MolecularWeight: 337.36916

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#CC1=CC=C(C=C1)C(=O)NCC2=CC3=C(C=C2)OCO3)O

Isomeric SMILES

CC(C)(C#CC1=CC=C(C=C1)C(=O)NCC2=CC3=C(C=C2)OCO3)O

InChI

InChI=1S/C20H19NO4/c1-20(2,23)10-9-14-3-6-16(7-4-14)19(22)21-12-15-5-8-17-18(11-15)25-13-24-17/h3-8,11,23H,12-13H2,1-2H3,(H,21,22)