ethanoic acid; ethyl 2-[[7-[(4-carbamimidoylphenyl)carbonylamino]-4-ethyl-3-oxidanylidene-1,4-benzoxazin-2-yl]oxy]ethanoate

Systemtic Name: ethanoic acid; ethyl 2-[[7-[(4-carbamimidoylphenyl)carbonylamino]-4-ethyl-3-oxidanylidene-1,4-benzoxazin-2-yl]oxy]ethanoate Openeye Name: acetic acid; ethyl 2-[[7-[(4-carbamimidoylbenzoyl)amino]-4-ethyl-3-oxo-1,4-benzoxazin-2-yl]oxy]acetate CAS Name: acetic acid; 2-[[7-[[(4-carbamimidoylphenyl)-oxomethyl]amino]-4-ethyl-3-oxo-1,4-benzoxazin-2-yl]oxy]acetic acid ethyl ester IUPAC Name: acetic acid; ethyl 2-[[7-[(4-carbamimidoylbenzoyl)amino]-4-ethyl-3-oxo-1,4-benzoxazin-2-yl]oxy]acetate Traditional Name: acetic acid; 2-[[7-[(4-amidinobenzoyl)amino]-4-ethyl-3-keto-1,4-benzoxazin-2-yl]oxy]acetic acid ethyl ester Formula: C24H28N4O8 MolecularWeight: 500.50112

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)NC(=O)C3=CC=C(C=C3)C(=N)N)OC(C1=O)OCC(=O)OCC.CC(=O)O

Isomeric SMILES

CCN1C2=C(C=C(C=C2)NC(=O)C3=CC=C(C=C3)C(=N)N)OC(C1=O)OCC(=O)OCC.CC(=O)O

InChI

InChI=1S/C22H24N4O6.C2H4O2/c1-3-26-16-10-9-15(25-20(28)14-7-5-13(6-8-14)19(23)24)11-17(16)32-22(21(26)29)31-12-18(27)30-4-2;1-2(3)4/h5-11,22H,3-4,12H2,1-2H3,(H3,23,24)(H,25,28);1H3,(H,3,4)