3-[2-[2-[(3-bromophenyl)amino]-2-oxidanylidene-ethoxy]ethanoylamino]propyl-diethyl-azanium

Systemtic Name: 3-[2-[2-[(3-bromophenyl)amino]-2-oxidanylidene-ethoxy]ethanoylamino]propyl-diethyl-azanium Openeye Name: 3-[[2-[2-(3-bromoanilino)-2-oxo-ethoxy]acetyl]amino]propyl-diethyl-ammonium CAS Name: 3-[[2-[2-(3-bromoanilino)-2-oxoethoxy]-1-oxoethyl]amino]propyl-diethylammonium IUPAC Name: 3-[[2-[2-(3-bromoanilino)-2-oxoethoxy]acetyl]amino]propyl-diethylazanium Traditional Name: 3-[[2-[2-(3-bromoanilino)-2-keto-ethoxy]acetyl]amino]propyl-diethyl-ammonium Formula: C17H27BrN3O3+ MolecularWeight: 401.31858

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCNC(=O)COCC(=O)NC1=CC(=CC=C1)Br

Isomeric SMILES

CC[NH+](CC)CCCNC(=O)COCC(=O)NC1=CC(=CC=C1)Br

InChI

InChI=1S/C17H26BrN3O3/c1-3-21(4-2)10-6-9-19-16(22)12-24-13-17(23)20-15-8-5-7-14(18)11-15/h5,7-8,11H,3-4,6,9-10,12-13H2,1-2H3,(H,19,22)(H,20,23)/p+1