N-[(4-butoxyphenyl)methyl]-1,3-benzodioxol-5-amine

Systemtic Name: N-[(4-butoxyphenyl)methyl]-1,3-benzodioxol-5-amine Openeye Name: N-[(4-butoxyphenyl)methyl]-1,3-benzodioxol-5-amine CAS Name: N-[(4-butoxyphenyl)methyl]-1,3-benzodioxol-5-amine IUPAC Name: N-[(4-butoxyphenyl)methyl]-1,3-benzodioxol-5-amine Traditional Name: 1,3-benzodioxol-5-yl-(4-butoxybenzyl)amine Formula: C18H21NO3 MolecularWeight: 299.36424

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)CNC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCCCOC1=CC=C(C=C1)CNC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C18H21NO3/c1-2-3-10-20-16-7-4-14(5-8-16)12-19-15-6-9-17-18(11-15)22-13-21-17/h4-9,11,19H,2-3,10,12-13H2,1H3