1-[1,3-bis(bromanyl)propan-2-yl]-6,7-diethoxy-1,2,3,4-tetrahydroisoquinoline

Systemtic Name: 1-[1,3-bis(bromanyl)propan-2-yl]-6,7-diethoxy-1,2,3,4-tetrahydroisoquinoline Openeye Name: 1-[2-bromo-1-(bromomethyl)ethyl]-6,7-diethoxy-1,2,3,4-tetrahydroisoquinoline CAS Name: 1-(1,3-dibromopropan-2-yl)-6,7-diethoxy-1,2,3,4-tetrahydroisoquinoline IUPAC Name: 1-(1,3-dibromopropan-2-yl)-6,7-diethoxy-1,2,3,4-tetrahydroisoquinoline Traditional Name: 1-[2-bromo-1-(bromomethyl)ethyl]-6,7-diethoxy-1,2,3,4-tetrahydroisoquinoline Formula: C16H23Br2NO2 MolecularWeight: 421.16732

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(NCCC2=C1)C(CBr)CBr)OCC

Isomeric SMILES

CCOC1=C(C=C2C(NCCC2=C1)C(CBr)CBr)OCC

InChI

InChI=1S/C16H23Br2NO2/c1-3-20-14-7-11-5-6-19-16(12(9-17)10-18)13(11)8-15(14)21-4-2/h7-8,12,16,19H,3-6,9-10H2,1-2H3