3,6-dimethyl-N-(2-nitrophenyl)-1-oxidanylidene-4H-isochromene-3-carboxamide

Systemtic Name: 3,6-dimethyl-N-(2-nitrophenyl)-1-oxidanylidene-4H-isochromene-3-carboxamide Openeye Name: 3,6-dimethyl-N-(2-nitrophenyl)-1-oxo-isochromane-3-carboxamide CAS Name: 3,6-dimethyl-N-(2-nitrophenyl)-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: 3,6-dimethyl-N-(2-nitrophenyl)-1-oxo-4H-isochromene-3-carboxamide Traditional Name: 1-keto-3,6-dimethyl-N-(2-nitrophenyl)isochroman-3-carboxamide Formula: C18H16N2O5 MolecularWeight: 340.33004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=O)OC(C2)(C)C(=O)NC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC1=CC2=C(C=C1)C(=O)OC(C2)(C)C(=O)NC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C18H16N2O5/c1-11-7-8-13-12(9-11)10-18(2,25-16(13)21)17(22)19-14-5-3-4-6-15(14)20(23)24/h3-9H,10H2,1-2H3,(H,19,22)