[2-[(3-bromanyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-ethyl-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]azanium

Systemtic Name: [2-[(3-bromanyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-ethyl-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]azanium Openeye Name: [2-(3-bromo-4-methyl-anilino)-2-oxo-ethyl]-ethyl-[2-(isopropylamino)-2-oxo-ethyl]ammonium CAS Name: [2-(3-bromo-4-methylanilino)-2-oxoethyl]-ethyl-[2-oxo-2-(propan-2-ylamino)ethyl]ammonium IUPAC Name: [2-(3-bromo-4-methylanilino)-2-oxoethyl]-ethyl-[2-oxo-2-(propan-2-ylamino)ethyl]azanium Traditional Name: [2-(3-bromo-4-methyl-anilino)-2-keto-ethyl]-ethyl-[2-(isopropylamino)-2-keto-ethyl]ammonium Formula: C16H25BrN3O2+ MolecularWeight: 371.2926

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC(=O)NC1=CC(=C(C=C1)C)Br)CC(=O)NC(C)C

Isomeric SMILES

CC[NH+](CC(=O)NC1=CC(=C(C=C1)C)Br)CC(=O)NC(C)C

InChI

InChI=1S/C16H24BrN3O2/c1-5-20(9-15(21)18-11(2)3)10-16(22)19-13-7-6-12(4)14(17)8-13/h6-8,11H,5,9-10H2,1-4H3,(H,18,21)(H,19,22)/p+1