(4-bromophenyl)methyl-methyl-[2-[(4-morpholin-4-ylphenyl)amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: (4-bromophenyl)methyl-methyl-[2-[(4-morpholin-4-ylphenyl)amino]-2-oxidanylidene-ethyl]azanium Openeye Name: (4-bromophenyl)methyl-methyl-[2-(4-morpholinoanilino)-2-oxo-ethyl]ammonium CAS Name: (4-bromophenyl)methyl-methyl-[2-[4-(4-morpholinyl)anilino]-2-oxoethyl]ammonium IUPAC Name: (4-bromophenyl)methyl-methyl-[2-(4-morpholin-4-ylanilino)-2-oxoethyl]azanium Traditional Name: (4-bromobenzyl)-[2-keto-2-(4-morpholinoanilino)ethyl]-methyl-ammonium Formula: C20H25BrN3O2+ MolecularWeight: 419.3354

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=C(C=C1)Br)CC(=O)NC2=CC=C(C=C2)N3CCOCC3

Isomeric SMILES

C[NH+](CC1=CC=C(C=C1)Br)CC(=O)NC2=CC=C(C=C2)N3CCOCC3

InChI

InChI=1S/C20H24BrN3O2/c1-23(14-16-2-4-17(21)5-3-16)15-20(25)22-18-6-8-19(9-7-18)24-10-12-26-13-11-24/h2-9H,10-15H2,1H3,(H,22,25)/p+1