2-[2-[2-[(3-bromophenyl)methylidene]-3-oxidanylidene-1,4-benzoxazin-4-yl]ethanoylamino]ethyl-diethyl-azanium

Systemtic Name: 2-[2-[2-[(3-bromophenyl)methylidene]-3-oxidanylidene-1,4-benzoxazin-4-yl]ethanoylamino]ethyl-diethyl-azanium Openeye Name: 2-[[2-[2-[(3-bromophenyl)methylene]-3-oxo-1,4-benzoxazin-4-yl]acetyl]amino]ethyl-diethyl-ammonium CAS Name: 2-[[2-[2-[(3-bromophenyl)methylidene]-3-oxo-1,4-benzoxazin-4-yl]-1-oxoethyl]amino]ethyl-diethylammonium IUPAC Name: 2-[[2-[2-[(3-bromophenyl)methylidene]-3-oxo-1,4-benzoxazin-4-yl]acetyl]amino]ethyl-diethylazanium Traditional Name: 2-[[2-[2-(3-bromobenzylidene)-3-keto-1,4-benzoxazin-4-yl]acetyl]amino]ethyl-diethyl-ammonium Formula: C23H27BrN3O3+ MolecularWeight: 473.38278

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCNC(=O)CN1C2=CC=CC=C2OC(=CC3=CC(=CC=C3)Br)C1=O

Isomeric SMILES

CC[NH+](CC)CCNC(=O)CN1C2=CC=CC=C2OC(=CC3=CC(=CC=C3)Br)C1=O

InChI

InChI=1S/C23H26BrN3O3/c1-3-26(4-2)13-12-25-22(28)16-27-19-10-5-6-11-20(19)30-21(23(27)29)15-17-8-7-9-18(24)14-17/h5-11,14-15H,3-4,12-13,16H2,1-2H3,(H,25,28)/p+1