8-bromanyl-6-(2-chlorophenyl)-1-methyl-4,5-dihydro-3H-1,5-benzodiazocin-1-ium-2-one

Systemtic Name: 8-bromanyl-6-(2-chlorophenyl)-1-methyl-4,5-dihydro-3H-1,5-benzodiazocin-1-ium-2-one Openeye Name: 8-bromo-6-(2-chlorophenyl)-1-methyl-4,5-dihydro-3H-1,5-benzodiazocin-1-ium-2-one CAS Name: 8-bromo-6-(2-chlorophenyl)-1-methyl-4,5-dihydro-3H-1,5-benzodiazocin-1-ium-2-one IUPAC Name: 8-bromo-6-(2-chlorophenyl)-1-methyl-4,5-dihydro-3H-1,5-benzodiazocin-1-ium-2-one Traditional Name: 8-bromo-6-(2-chlorophenyl)-1-methyl-4,5-dihydro-3H-1,5-benzodiazocin-1-ium-2-one Formula: C17H15BrClN2O+ MolecularWeight: 378.6708

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C2C=CC(=CC2=C(NCCC1=O)C3=CC=CC=C3Cl)Br

Isomeric SMILES

C[N+]1=C2C=CC(=CC2=C(NCCC1=O)C3=CC=CC=C3Cl)Br

InChI

InChI=1S/C17H14BrClN2O/c1-21-15-7-6-11(18)10-13(15)17(20-9-8-16(21)22)12-4-2-3-5-14(12)19/h2-7,10H,8-9H2,1H3/p+1