2-(3-oxidanylidene-4H-pyrido[3,2-b][1,4]oxazin-2-yl)ethyl 4-nitrobenzoate

Systemtic Name: 2-(3-oxidanylidene-4H-pyrido[3,2-b][1,4]oxazin-2-yl)ethyl 4-nitrobenzoate Openeye Name: 2-(3-oxo-4H-pyrido[3,2-b][1,4]oxazin-2-yl)ethyl 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid 2-(3-oxo-4H-pyrido[3,2-b][1,4]oxazin-2-yl)ethyl ester IUPAC Name: 2-(3-oxo-4H-pyrido[3,2-b][1,4]oxazin-2-yl)ethyl 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid 2-(3-keto-4H-pyrido[3,2-b][1,4]oxazin-2-yl)ethyl ester Formula: C16H13N3O6 MolecularWeight: 343.29092

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(NC(=O)C(O2)CCOC(=O)C3=CC=C(C=C3)[N+](=O)[O-])N=C1

Isomeric SMILES

C1=CC2=C(NC(=O)C(O2)CCOC(=O)C3=CC=C(C=C3)[N+](=O)[O-])N=C1

InChI

InChI=1S/C16H13N3O6/c20-15-13(25-12-2-1-8-17-14(12)18-15)7-9-24-16(21)10-3-5-11(6-4-10)19(22)23/h1-6,8,13H,7,9H2,(H,17,18,20)