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

Systemtic Name: [2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-[(2R)-1-oxidanylidene-1-pyrrolidin-1-yl-propan-2-yl]azanium Openeye Name: [2-(4-bromo-2-methyl-anilino)-2-oxo-ethyl]-methyl-[(1R)-1-methyl-2-oxo-2-pyrrolidin-1-yl-ethyl]ammonium CAS Name: [2-(4-bromo-2-methylanilino)-2-oxoethyl]-methyl-[(2R)-1-oxo-1-(1-pyrrolidinyl)propan-2-yl]ammonium IUPAC Name: [2-(4-bromo-2-methylanilino)-2-oxoethyl]-methyl-[(2R)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]azanium Traditional Name: [2-(4-bromo-2-methyl-anilino)-2-keto-ethyl]-[(1R)-2-keto-1-methyl-2-pyrrolidino-ethyl]-methyl-ammonium Formula: C17H25BrN3O2+ MolecularWeight: 383.3033

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)C[NH+](C)C(C)C(=O)N2CCCC2

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)C[NH+](C)[C@H](C)C(=O)N2CCCC2

InChI

InChI=1S/C17H24BrN3O2/c1-12-10-14(18)6-7-15(12)19-16(22)11-20(3)13(2)17(23)21-8-4-5-9-21/h6-7,10,13H,4-5,8-9,11H2,1-3H3,(H,19,22)/p+1/t13-/m1/s1