(4E)-7-methyl-4-[(3-nitrophenyl)methylidene]-2,3-dihydro-1-benzoxepin-5-one

Systemtic Name: (4E)-7-methyl-4-[(3-nitrophenyl)methylidene]-2,3-dihydro-1-benzoxepin-5-one Openeye Name: (4E)-7-methyl-4-[(3-nitrophenyl)methylene]-2,3-dihydro-1-benzoxepin-5-one CAS Name: (4E)-7-methyl-4-[(3-nitrophenyl)methylidene]-2,3-dihydro-1-benzoxepin-5-one IUPAC Name: (4E)-7-methyl-4-[(3-nitrophenyl)methylidene]-2,3-dihydro-1-benzoxepin-5-one Traditional Name: (4E)-7-methyl-4-(3-nitrobenzylidene)-2,3-dihydro-1-benzoxepin-5-one Formula: C18H15NO4 MolecularWeight: 309.316

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OCCC(=CC3=CC(=CC=C3)[N+](=O)[O-])C2=O

Isomeric SMILES

CC1=CC2=C(C=C1)OCC/C(=C\C3=CC(=CC=C3)[N+](=O)[O-])/C2=O

InChI

InChI=1S/C18H15NO4/c1-12-5-6-17-16(9-12)18(20)14(7-8-23-17)10-13-3-2-4-15(11-13)19(21)22/h2-6,9-11H,7-8H2,1H3/b14-10+