5-nitro-2-[(2,4,6-trimethylphenyl)amino]cyclohepta-2,4,6-trien-1-one

Systemtic Name: 5-nitro-2-[(2,4,6-trimethylphenyl)amino]cyclohepta-2,4,6-trien-1-one Openeye Name: 5-nitro-2-(2,4,6-trimethylanilino)cyclohepta-2,4,6-trien-1-one CAS Name: 5-nitro-2-(2,4,6-trimethylanilino)-1-cyclohepta-2,4,6-trienone IUPAC Name: 5-nitro-2-(2,4,6-trimethylanilino)cyclohepta-2,4,6-trien-1-one Traditional Name: 2-mesidino-5-nitro-cyclohepta-2,4,6-trien-1-one Formula: C16H16N2O3 MolecularWeight: 284.30984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC2=CC=C(C=CC2=O)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC2=CC=C(C=CC2=O)[N+](=O)[O-])C

InChI

InChI=1S/C16H16N2O3/c1-10-8-11(2)16(12(3)9-10)17-14-6-4-13(18(20)21)5-7-15(14)19/h4-9H,1-3H3,(H,17,19)