(4-bromophenyl)methyl-[2-[[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]-methyl-amino]-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: (4-bromophenyl)methyl-[2-[[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]-methyl-amino]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: (4-bromophenyl)methyl-[2-[[2-(2-furylmethylamino)-2-oxo-ethyl]-methyl-amino]-2-oxo-ethyl]-methyl-ammonium CAS Name: (4-bromophenyl)methyl-[2-[[2-(2-furanylmethylamino)-2-oxoethyl]-methylamino]-2-oxoethyl]-methylammonium IUPAC Name: (4-bromophenyl)methyl-[2-[[2-(furan-2-ylmethylamino)-2-oxoethyl]-methylamino]-2-oxoethyl]-methylazanium Traditional Name: (4-bromobenzyl)-[2-[[2-(2-furfurylamino)-2-keto-ethyl]-methyl-amino]-2-keto-ethyl]-methyl-ammonium Formula: C18H23BrN3O3+ MolecularWeight: 409.29752

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=C(C=C1)Br)CC(=O)N(C)CC(=O)NCC2=CC=CO2

Isomeric SMILES

C[NH+](CC1=CC=C(C=C1)Br)CC(=O)N(C)CC(=O)NCC2=CC=CO2

InChI

InChI=1S/C18H22BrN3O3/c1-21(11-14-5-7-15(19)8-6-14)13-18(24)22(2)12-17(23)20-10-16-4-3-9-25-16/h3-9H,10-13H2,1-2H3,(H,20,23)/p+1