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4-[[2-[(2,4-dimethyl-1,5-benzodiazepin-3-ylidene)amino]oxy-1-oxoethyl]amino]benzoic acid ethyl ester
SpectraBase Compound ID oZGZLfKUfS
InChI InChI=1S/C22H22N4O4/c1-4-29-22(28)16-9-11-17(12-10-16)25-20(27)13-30-26-21-14(2)23-18-7-5-6-8-19(18)24-15(21)3/h5-12H,4,13H2,1-3H3,(H,25,27)
InChIKey KOONFYSSBVIUBE-UHFFFAOYSA-N
Mol Weight 406.44 g/mol
Molecular Formula C22H22N4O4
Exact Mass 406.164105 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DMsrhl0iOkG
Name 4-[[2-[(2,4-dimethyl-1,5-benzodiazepin-3-ylidene)amino]oxy-1-oxoethyl]amino]benzoic acid ethyl ester
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Formula C22H22N4O4
InChI InChI=1S/C22H22N4O4/c1-4-29-22(28)16-9-11-17(12-10-16)25-20(27)13-30-26-21-14(2)23-18-7-5-6-8-19(18)24-15(21)3/h5-12H,4,13H2,1-3H3,(H,25,27)
InChIKey KOONFYSSBVIUBE-UHFFFAOYSA-N
Molecular Weight 406.442 g/mol
SMILES N(C(CON=C1C(=Nc2ccccc2N=C1C)C)=O)c1ccc(C(=O)OCC)cc1
SPLASH splash10-001i-4900000000-21e4dffbf31b23f89c7d
Synonyms 4-[[2-[(2,4-dimethyl-1,5-benzodiazepin-3-ylidene)amino]oxyacetyl]amino]benzoic acid ethyl ester Ethyl 4-[({[(2,4-dimethyl-3H-1,5-benzodiazepin-3-ylidene)amino]oxy}acetyl)amino]benzoate Ethyl 4-[2-[(2,4-dimethyl-1,5-benzodiazepin-3-ylidene)amino]oxyethanoylamino]benzoate Ethyl 4-[[2-[(2,4-dimethyl-1,5-benzodiazepin-3-ylidene)amino]oxyacetyl]amino]benzoate
Wiley ID 1442633