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

Systemtic Name: (4-bromophenyl)methyl-[2-[[2-(furan-2-ylmethylcarbamoyl)phenyl]amino]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: (4-bromophenyl)methyl-[2-[2-(2-furylmethylcarbamoyl)anilino]-2-oxo-ethyl]-methyl-ammonium CAS Name: (4-bromophenyl)methyl-[2-[2-[(2-furanylmethylamino)-oxomethyl]anilino]-2-oxoethyl]-methylammonium IUPAC Name: (4-bromophenyl)methyl-[2-[2-(furan-2-ylmethylcarbamoyl)anilino]-2-oxoethyl]-methylazanium Traditional Name: (4-bromobenzyl)-[2-[2-(2-furfurylcarbamoyl)anilino]-2-keto-ethyl]-methyl-ammonium Formula: C22H23BrN3O3+ MolecularWeight: 457.34032

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=C(C=C1)Br)CC(=O)NC2=CC=CC=C2C(=O)NCC3=CC=CO3

Isomeric SMILES

C[NH+](CC1=CC=C(C=C1)Br)CC(=O)NC2=CC=CC=C2C(=O)NCC3=CC=CO3

InChI

InChI=1S/C22H22BrN3O3/c1-26(14-16-8-10-17(23)11-9-16)15-21(27)25-20-7-3-2-6-19(20)22(28)24-13-18-5-4-12-29-18/h2-12H,13-15H2,1H3,(H,24,28)(H,25,27)/p+1