(1Z)-3-methyl-1-[(4-nitrophenyl)methylidene]-4,5-dihydro-3H-2,1-benzoxazepin-1-ium

Systemtic Name: (1Z)-3-methyl-1-[(4-nitrophenyl)methylidene]-4,5-dihydro-3H-2,1-benzoxazepin-1-ium Openeye Name: (1Z)-3-methyl-1-[(4-nitrophenyl)methylene]-4,5-dihydro-3H-2,1-benzoxazepin-1-ium CAS Name: (1Z)-3-methyl-1-[(4-nitrophenyl)methylidene]-4,5-dihydro-3H-2,1-benzoxazepin-1-ium IUPAC Name: (1Z)-3-methyl-1-[(4-nitrophenyl)methylidene]-4,5-dihydro-3H-2,1-benzoxazepin-1-ium Traditional Name: (1Z)-3-methyl-1-(4-nitrobenzylidene)-4,5-dihydro-3H-2,1-benzoxazepin-1-ium Formula: C17H17N2O3+ MolecularWeight: 297.32848

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=CC=CC=C2[N+](=CC3=CC=C(C=C3)[N+](=O)[O-])O1

Isomeric SMILES

CC1CCC2=CC=CC=C2/[N+](=C/C3=CC=C(C=C3)[N+](=O)[O-])/O1

InChI

InChI=1S/C17H17N2O3/c1-13-6-9-15-4-2-3-5-17(15)18(22-13)12-14-7-10-16(11-8-14)19(20)21/h2-5,7-8,10-13H,6,9H2,1H3/q+1/b18-12-