2-[[(2S)-3-(4-bromophenyl)-3-oxidanylidene-2-(2-oxidanylidenepyridin-1-yl)propanoyl]amino]ethyl-diethyl-azanium

Systemtic Name: 2-[[(2S)-3-(4-bromophenyl)-3-oxidanylidene-2-(2-oxidanylidenepyridin-1-yl)propanoyl]amino]ethyl-diethyl-azanium Openeye Name: 2-[[(2S)-3-(4-bromophenyl)-3-oxo-2-(2-oxo-1-pyridyl)propanoyl]amino]ethyl-diethyl-ammonium CAS Name: 2-[[(2S)-3-(4-bromophenyl)-1,3-dioxo-2-(2-oxo-1-pyridinyl)propyl]amino]ethyl-diethylammonium IUPAC Name: 2-[[(2S)-3-(4-bromophenyl)-3-oxo-2-(2-oxopyridin-1-yl)propanoyl]amino]ethyl-diethylazanium Traditional Name: 2-[[(2S)-3-(4-bromophenyl)-3-keto-2-(2-keto-1-pyridyl)propanoyl]amino]ethyl-diethyl-ammonium Formula: C20H25BrN3O3+ MolecularWeight: 435.3348

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCNC(=O)C(C(=O)C1=CC=C(C=C1)Br)N2C=CC=CC2=O

Isomeric SMILES

CC[NH+](CC)CCNC(=O)[C@H](C(=O)C1=CC=C(C=C1)Br)N2C=CC=CC2=O

InChI

InChI=1S/C20H24BrN3O3/c1-3-23(4-2)14-12-22-20(27)18(24-13-6-5-7-17(24)25)19(26)15-8-10-16(21)11-9-15/h5-11,13,18H,3-4,12,14H2,1-2H3,(H,22,27)/p+1/t18-/m0/s1