3-methyl-4-(4-nitrophenyl)azepin-2-imine

Systemtic Name: 3-methyl-4-(4-nitrophenyl)azepin-2-imine Openeye Name: 3-methyl-4-(4-nitrophenyl)azepin-2-imine CAS Name: 3-methyl-4-(4-nitrophenyl)-2-azepinimine IUPAC Name: 3-methyl-4-(4-nitrophenyl)azepin-2-imine Traditional Name: [3-methyl-4-(4-nitrophenyl)azepin-2-ylidene]amine Formula: C13H11N3O2 MolecularWeight: 241.24534

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=NC1=N)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC=NC1=N)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H11N3O2/c1-9-12(3-2-8-15-13(9)14)10-4-6-11(7-5-10)16(17)18/h2-8,14H,1H3