N-[(6-bromanyl-1,3-benzodioxol-5-yl)methyl]-4-propyl-aniline

Systemtic Name: N-[(6-bromanyl-1,3-benzodioxol-5-yl)methyl]-4-propyl-aniline Openeye Name: N-[(6-bromo-1,3-benzodioxol-5-yl)methyl]-4-propyl-aniline CAS Name: N-[(6-bromo-1,3-benzodioxol-5-yl)methyl]-4-propylaniline IUPAC Name: N-[(6-bromo-1,3-benzodioxol-5-yl)methyl]-4-propylaniline Traditional Name: (6-bromo-1,3-benzodioxol-5-yl)methyl-(4-propylphenyl)amine Formula: C17H18BrNO2 MolecularWeight: 348.23432

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)NCC2=CC3=C(C=C2Br)OCO3

Isomeric SMILES

CCCC1=CC=C(C=C1)NCC2=CC3=C(C=C2Br)OCO3

InChI

InChI=1S/C17H18BrNO2/c1-2-3-12-4-6-14(7-5-12)19-10-13-8-16-17(9-15(13)18)21-11-20-16/h4-9,19H,2-3,10-11H2,1H3