[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-[2-(2-methylpropylamino)-2-oxidanylidene-ethyl]azanium

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)C[NH+](C)CC(=O)NCC(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)C[NH+](C)CC(=O)NCC(C)C

InChI

InChI=1S/C16H24BrN3O2/c1-11(2)8-18-15(21)9-20(4)10-16(22)19-14-6-5-13(17)7-12(14)3/h5-7,11H,8-10H2,1-4H3,(H,18,21)(H,19,22)/p+1