[2-oxidanylidene-2-(3-phenyl-2,3-dihydro-1,4-benzoxazin-4-yl)ethyl] 4-azanyl-3-nitro-benzoate

Systemtic Name: [2-oxidanylidene-2-(3-phenyl-2,3-dihydro-1,4-benzoxazin-4-yl)ethyl] 4-azanyl-3-nitro-benzoate Openeye Name: [2-oxo-2-(3-phenyl-2,3-dihydro-1,4-benzoxazin-4-yl)ethyl] 4-amino-3-nitro-benzoate CAS Name: 4-amino-3-nitrobenzoic acid [2-oxo-2-(3-phenyl-2,3-dihydro-1,4-benzoxazin-4-yl)ethyl] ester IUPAC Name: [2-oxo-2-(3-phenyl-2,3-dihydro-1,4-benzoxazin-4-yl)ethyl] 4-amino-3-nitrobenzoate Traditional Name: 4-amino-3-nitro-benzoic acid [2-keto-2-(3-phenyl-2,3-dihydro-1,4-benzoxazin-4-yl)ethyl] ester Formula: C23H19N3O6 MolecularWeight: 433.41346

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(C2=CC=CC=C2O1)C(=O)COC(=O)C3=CC(=C(C=C3)N)[N+](=O)[O-])C4=CC=CC=C4

Isomeric SMILES

C1C(N(C2=CC=CC=C2O1)C(=O)COC(=O)C3=CC(=C(C=C3)N)[N+](=O)[O-])C4=CC=CC=C4

InChI

InChI=1S/C23H19N3O6/c24-17-11-10-16(12-19(17)26(29)30)23(28)32-14-22(27)25-18-8-4-5-9-21(18)31-13-20(25)15-6-2-1-3-7-15/h1-12,20H,13-14,24H2