[5-(4-bromophenyl)furan-2-yl]methyl-[(2R)-1-(cyclopropylamino)-1-oxidanylidene-propan-2-yl]-methyl-azanium

Systemtic Name: [5-(4-bromophenyl)furan-2-yl]methyl-[(2R)-1-(cyclopropylamino)-1-oxidanylidene-propan-2-yl]-methyl-azanium Openeye Name: [5-(4-bromophenyl)-2-furyl]methyl-[(1R)-2-(cyclopropylamino)-1-methyl-2-oxo-ethyl]-methyl-ammonium CAS Name: [5-(4-bromophenyl)-2-furanyl]methyl-[(2R)-1-(cyclopropylamino)-1-oxopropan-2-yl]-methylammonium IUPAC Name: [5-(4-bromophenyl)furan-2-yl]methyl-[(2R)-1-(cyclopropylamino)-1-oxopropan-2-yl]-methylazanium Traditional Name: [5-(4-bromophenyl)-2-furyl]methyl-[(1R)-2-(cyclopropylamino)-2-keto-1-methyl-ethyl]-methyl-ammonium Formula: C18H22BrN2O2+ MolecularWeight: 378.28348

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CC1)[NH+](C)CC2=CC=C(O2)C3=CC=C(C=C3)Br

Isomeric SMILES

C[C@H](C(=O)NC1CC1)[NH+](C)CC2=CC=C(O2)C3=CC=C(C=C3)Br

InChI

InChI=1S/C18H21BrN2O2/c1-12(18(22)20-15-7-8-15)21(2)11-16-9-10-17(23-16)13-3-5-14(19)6-4-13/h3-6,9-10,12,15H,7-8,11H2,1-2H3,(H,20,22)/p+1/t12-/m1/s1