2-ethyl-4-[2-(4-nitrophenyl)-2-oxidanylidene-ethyl]-1,4-benzoxazepine-3,5-dione

Systemtic Name: 2-ethyl-4-[2-(4-nitrophenyl)-2-oxidanylidene-ethyl]-1,4-benzoxazepine-3,5-dione Openeye Name: 2-ethyl-4-[2-(4-nitrophenyl)-2-oxo-ethyl]-1,4-benzoxazepine-3,5-dione CAS Name: 2-ethyl-4-[2-(4-nitrophenyl)-2-oxoethyl]-1,4-benzoxazepine-3,5-dione IUPAC Name: 2-ethyl-4-[2-(4-nitrophenyl)-2-oxoethyl]-1,4-benzoxazepine-3,5-dione Traditional Name: 2-ethyl-4-[2-keto-2-(4-nitrophenyl)ethyl]-1,4-benzoxazepine-3,5-quinone Formula: C19H16N2O6 MolecularWeight: 368.34014

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=O)N(C(=O)C2=CC=CC=C2O1)CC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCC1C(=O)N(C(=O)C2=CC=CC=C2O1)CC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H16N2O6/c1-2-16-19(24)20(18(23)14-5-3-4-6-17(14)27-16)11-15(22)12-7-9-13(10-8-12)21(25)26/h3-10,16H,2,11H2,1H3