(4-bromophenyl)methyl-[2-[2-(3-chlorophenyl)ethylamino]-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: (4-bromophenyl)methyl-[2-[2-(3-chlorophenyl)ethylamino]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: (4-bromophenyl)methyl-[2-[2-(3-chlorophenyl)ethylamino]-2-oxo-ethyl]-methyl-ammonium CAS Name: (4-bromophenyl)methyl-[2-[2-(3-chlorophenyl)ethylamino]-2-oxoethyl]-methylammonium IUPAC Name: (4-bromophenyl)methyl-[2-[2-(3-chlorophenyl)ethylamino]-2-oxoethyl]-methylazanium Traditional Name: (4-bromobenzyl)-[2-[2-(3-chlorophenyl)ethylamino]-2-keto-ethyl]-methyl-ammonium Formula: C18H21BrClN2O+ MolecularWeight: 396.72914

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=C(C=C1)Br)CC(=O)NCCC2=CC(=CC=C2)Cl

Isomeric SMILES

C[NH+](CC1=CC=C(C=C1)Br)CC(=O)NCCC2=CC(=CC=C2)Cl

InChI

InChI=1S/C18H20BrClN2O/c1-22(12-15-5-7-16(19)8-6-15)13-18(23)21-10-9-14-3-2-4-17(20)11-14/h2-8,11H,9-10,12-13H2,1H3,(H,21,23)/p+1