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

Systemtic Name: [2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-[2-[[(1R)-1-(furan-2-yl)ethyl]amino]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: [2-(4-bromo-2-methyl-anilino)-2-oxo-ethyl]-[2-[[(1R)-1-(2-furyl)ethyl]amino]-2-oxo-ethyl]-methyl-ammonium CAS Name: [2-(4-bromo-2-methylanilino)-2-oxoethyl]-[2-[[(1R)-1-(2-furanyl)ethyl]amino]-2-oxoethyl]-methylammonium IUPAC Name: [2-(4-bromo-2-methylanilino)-2-oxoethyl]-[2-[[(1R)-1-(furan-2-yl)ethyl]amino]-2-oxoethyl]-methylazanium Traditional Name: [2-(4-bromo-2-methyl-anilino)-2-keto-ethyl]-[2-[[(1R)-1-(2-furyl)ethyl]amino]-2-keto-ethyl]-methyl-ammonium Formula: C18H23BrN3O3+ MolecularWeight: 409.29752

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)C[NH+](C)CC(=O)NC(C)C2=CC=CO2

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)C[NH+](C)CC(=O)N[C@H](C)C2=CC=CO2

InChI

InChI=1S/C18H22BrN3O3/c1-12-9-14(19)6-7-15(12)21-18(24)11-22(3)10-17(23)20-13(2)16-5-4-8-25-16/h4-9,13H,10-11H2,1-3H3,(H,20,23)(H,21,24)/p+1/t13-/m1/s1