6-bromanyl-3-methyl-N-(4-nitrophenyl)-1-oxidanylidene-4H-isochromene-3-carboxamide

Systemtic Name: 6-bromanyl-3-methyl-N-(4-nitrophenyl)-1-oxidanylidene-4H-isochromene-3-carboxamide Openeye Name: 6-bromo-3-methyl-N-(4-nitrophenyl)-1-oxo-isochromane-3-carboxamide CAS Name: 6-bromo-3-methyl-N-(4-nitrophenyl)-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: 6-bromo-3-methyl-N-(4-nitrophenyl)-1-oxo-4H-isochromene-3-carboxamide Traditional Name: 6-bromo-1-keto-3-methyl-N-(4-nitrophenyl)isochroman-3-carboxamide Formula: C17H13BrN2O5 MolecularWeight: 405.19952

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C=CC(=C2)Br)C(=O)O1)C(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1(CC2=C(C=CC(=C2)Br)C(=O)O1)C(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H13BrN2O5/c1-17(9-10-8-11(18)2-7-14(10)15(21)25-17)16(22)19-12-3-5-13(6-4-12)20(23)24/h2-8H,9H2,1H3,(H,19,22)