N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-(3-tert-butylphenoxy)propanamide

Systemtic Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-(3-tert-butylphenoxy)propanamide Openeye Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-(3-tert-butylphenoxy)propanamide CAS Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-(3-tert-butylphenoxy)propanamide IUPAC Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-(3-tert-butylphenoxy)propanamide Traditional Name: 2-(3-tert-butylphenoxy)-N-homopiperonyl-propionamide Formula: C22H27NO4 MolecularWeight: 369.45408

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCC1=CC2=C(C=C1)OCO2)OC3=CC=CC(=C3)C(C)(C)C

Isomeric SMILES

CC(C(=O)NCCC1=CC2=C(C=C1)OCO2)OC3=CC=CC(=C3)C(C)(C)C

InChI

InChI=1S/C22H27NO4/c1-15(27-18-7-5-6-17(13-18)22(2,3)4)21(24)23-11-10-16-8-9-19-20(12-16)26-14-25-19/h5-9,12-13,15H,10-11,14H2,1-4H3,(H,23,24)