4-[2-(4-methoxy-3-nitro-phenyl)-2-oxidanylidene-ethyl]-1,4-benzoxazepine-3,5-dione

Systemtic Name: 4-[2-(4-methoxy-3-nitro-phenyl)-2-oxidanylidene-ethyl]-1,4-benzoxazepine-3,5-dione Openeye Name: 4-[2-(4-methoxy-3-nitro-phenyl)-2-oxo-ethyl]-1,4-benzoxazepine-3,5-dione CAS Name: 4-[2-(4-methoxy-3-nitrophenyl)-2-oxoethyl]-1,4-benzoxazepine-3,5-dione IUPAC Name: 4-[2-(4-methoxy-3-nitrophenyl)-2-oxoethyl]-1,4-benzoxazepine-3,5-dione Traditional Name: 4-[2-keto-2-(4-methoxy-3-nitro-phenyl)ethyl]-1,4-benzoxazepine-3,5-quinone Formula: C18H14N2O7 MolecularWeight: 370.31296

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)CN2C(=O)COC3=CC=CC=C3C2=O)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)CN2C(=O)COC3=CC=CC=C3C2=O)[N+](=O)[O-]

InChI

InChI=1S/C18H14N2O7/c1-26-16-7-6-11(8-13(16)20(24)25)14(21)9-19-17(22)10-27-15-5-3-2-4-12(15)18(19)23/h2-8H,9-10H2,1H3