[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-[2-(4-methylpiperidin-1-yl)-2-oxidanylidene-ethyl]azanium

Systemtic Name: [2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-[2-(4-methylpiperidin-1-yl)-2-oxidanylidene-ethyl]azanium Openeye Name: [2-(4-bromo-2-methyl-anilino)-2-oxo-ethyl]-methyl-[2-(4-methyl-1-piperidyl)-2-oxo-ethyl]ammonium CAS Name: [2-(4-bromo-2-methylanilino)-2-oxoethyl]-methyl-[2-(4-methyl-1-piperidinyl)-2-oxoethyl]ammonium IUPAC Name: [2-(4-bromo-2-methylanilino)-2-oxoethyl]-methyl-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]azanium Traditional Name: [2-(4-bromo-2-methyl-anilino)-2-keto-ethyl]-[2-keto-2-(4-methylpiperidino)ethyl]-methyl-ammonium Formula: C18H27BrN3O2+ MolecularWeight: 397.32988

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)C[NH+](C)CC(=O)NC2=C(C=C(C=C2)Br)C

Isomeric SMILES

CC1CCN(CC1)C(=O)C[NH+](C)CC(=O)NC2=C(C=C(C=C2)Br)C

InChI

InChI=1S/C18H26BrN3O2/c1-13-6-8-22(9-7-13)18(24)12-21(3)11-17(23)20-16-5-4-15(19)10-14(16)2/h4-5,10,13H,6-9,11-12H2,1-3H3,(H,20,23)/p+1