[2-[2-(4-bromanylphenoxy)ethyl-methyl-amino]-2-oxidanylidene-ethyl]-methyl-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]azanium

Systemtic Name: [2-[2-(4-bromanylphenoxy)ethyl-methyl-amino]-2-oxidanylidene-ethyl]-methyl-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]azanium Openeye Name: [2-[2-(4-bromophenoxy)ethyl-methyl-amino]-2-oxo-ethyl]-[2-(isopropylamino)-2-oxo-ethyl]-methyl-ammonium CAS Name: [2-[2-(4-bromophenoxy)ethyl-methylamino]-2-oxoethyl]-methyl-[2-oxo-2-(propan-2-ylamino)ethyl]ammonium IUPAC Name: [2-[2-(4-bromophenoxy)ethyl-methylamino]-2-oxoethyl]-methyl-[2-oxo-2-(propan-2-ylamino)ethyl]azanium Traditional Name: [2-[2-(4-bromophenoxy)ethyl-methyl-amino]-2-keto-ethyl]-[2-(isopropylamino)-2-keto-ethyl]-methyl-ammonium Formula: C17H27BrN3O3+ MolecularWeight: 401.31858

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C[NH+](C)CC(=O)N(C)CCOC1=CC=C(C=C1)Br

Isomeric SMILES

CC(C)NC(=O)C[NH+](C)CC(=O)N(C)CCOC1=CC=C(C=C1)Br

InChI

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