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

Systemtic Name: N-[(6-bromanyl-1,3-benzodioxol-5-yl)methyl]-1-pyridin-4-yl-ethanamine Openeye Name: N-[(6-bromo-1,3-benzodioxol-5-yl)methyl]-1-(4-pyridyl)ethanamine CAS Name: N-[(6-bromo-1,3-benzodioxol-5-yl)methyl]-1-pyridin-4-ylethanamine IUPAC Name: N-[(6-bromo-1,3-benzodioxol-5-yl)methyl]-1-pyridin-4-ylethanamine Traditional Name: (6-bromo-1,3-benzodioxol-5-yl)methyl-[1-(4-pyridyl)ethyl]amine Formula: C15H15BrN2O2 MolecularWeight: 335.1958

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H15BrN2O2/c1-10(11-2-4-17-5-3-11)18-8-12-6-14-15(7-13(12)16)20-9-19-14/h2-7,10,18H,8-9H2,1H3