butyl 2-chloranyl-5-[2-(6-chloranyl-3-oxidanylidene-1,4-benzoxazin-4-yl)ethanoylamino]benzoate

Systemtic Name: butyl 2-chloranyl-5-[2-(6-chloranyl-3-oxidanylidene-1,4-benzoxazin-4-yl)ethanoylamino]benzoate Openeye Name: butyl 2-chloro-5-[[2-(6-chloro-3-oxo-1,4-benzoxazin-4-yl)acetyl]amino]benzoate CAS Name: 2-chloro-5-[[2-(6-chloro-3-oxo-1,4-benzoxazin-4-yl)-1-oxoethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 2-chloro-5-[[2-(6-chloro-3-oxo-1,4-benzoxazin-4-yl)acetyl]amino]benzoate Traditional Name: 2-chloro-5-[[2-(6-chloro-3-keto-1,4-benzoxazin-4-yl)acetyl]amino]benzoic acid butyl ester Formula: C21H20Cl2N2O5 MolecularWeight: 451.2999

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=C(C=CC(=C1)NC(=O)CN2C(=O)COC3=C2C=C(C=C3)Cl)Cl

Isomeric SMILES

CCCCOC(=O)C1=C(C=CC(=C1)NC(=O)CN2C(=O)COC3=C2C=C(C=C3)Cl)Cl

InChI

InChI=1S/C21H20Cl2N2O5/c1-2-3-8-29-21(28)15-10-14(5-6-16(15)23)24-19(26)11-25-17-9-13(22)4-7-18(17)30-12-20(25)27/h4-7,9-10H,2-3,8,11-12H2,1H3,(H,24,26)