2-(4-chloranylphenoxy)ethyl 2-(6-nitro-3-oxidanylidene-1,4-benzoxazin-4-yl)ethanoate

Systemtic Name: 2-(4-chloranylphenoxy)ethyl 2-(6-nitro-3-oxidanylidene-1,4-benzoxazin-4-yl)ethanoate Openeye Name: 2-(4-chlorophenoxy)ethyl 2-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)acetate CAS Name: 2-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)acetic acid 2-(4-chlorophenoxy)ethyl ester IUPAC Name: 2-(4-chlorophenoxy)ethyl 2-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)acetate Traditional Name: 2-(3-keto-6-nitro-1,4-benzoxazin-4-yl)acetic acid 2-(4-chlorophenoxy)ethyl ester Formula: C18H15ClN2O7 MolecularWeight: 406.7739

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N(C2=C(O1)C=CC(=C2)[N+](=O)[O-])CC(=O)OCCOC3=CC=C(C=C3)Cl

Isomeric SMILES

C1C(=O)N(C2=C(O1)C=CC(=C2)[N+](=O)[O-])CC(=O)OCCOC3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H15ClN2O7/c19-12-1-4-14(5-2-12)26-7-8-27-18(23)10-20-15-9-13(21(24)25)3-6-16(15)28-11-17(20)22/h1-6,9H,7-8,10-11H2