(4E)-4-[ethoxy(oxidanyl)methylidene]-7-nitro-3-propan-2-ylidene-1-benzoxepine-2,5-dione

Systemtic Name: (4E)-4-[ethoxy(oxidanyl)methylidene]-7-nitro-3-propan-2-ylidene-1-benzoxepine-2,5-dione Openeye Name: (4E)-4-[ethoxy(hydroxy)methylene]-3-isopropylidene-7-nitro-1-benzoxepine-2,5-dione CAS Name: (4E)-4-[ethoxy(hydroxy)methylidene]-7-nitro-3-propan-2-ylidene-1-benzoxepin-2,5-dione IUPAC Name: (4E)-4-[ethoxy(hydroxy)methylidene]-7-nitro-3-propan-2-ylidene-1-benzoxepine-2,5-dione Traditional Name: (4E)-4-[ethoxy(hydroxy)methylene]-3-isopropylidene-7-nitro-1-benzoxepin-2,5-quinone Formula: C16H15NO7 MolecularWeight: 333.2928

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=C1C(=C(C)C)C(=O)OC2=C(C1=O)C=C(C=C2)[N+](=O)[O-])O

Isomeric SMILES

CCO/C(=C/1\C(=C(C)C)C(=O)OC2=C(C1=O)C=C(C=C2)[N+](=O)[O-])/O

InChI

InChI=1S/C16H15NO7/c1-4-23-15(19)13-12(8(2)3)16(20)24-11-6-5-9(17(21)22)7-10(11)14(13)18/h5-7,19H,4H2,1-3H3/b15-13+