N-(2-bromanyl-4-nitro-phenyl)-6-ethyl-1-oxidanylidene-3,4-dihydroisochromene-3-carboxamide

Systemtic Name: N-(2-bromanyl-4-nitro-phenyl)-6-ethyl-1-oxidanylidene-3,4-dihydroisochromene-3-carboxamide Openeye Name: N-(2-bromo-4-nitro-phenyl)-6-ethyl-1-oxo-isochromane-3-carboxamide CAS Name: N-(2-bromo-4-nitrophenyl)-6-ethyl-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: N-(2-bromo-4-nitrophenyl)-6-ethyl-1-oxo-3,4-dihydroisochromene-3-carboxamide Traditional Name: N-(2-bromo-4-nitro-phenyl)-6-ethyl-1-keto-isochroman-3-carboxamide Formula: C18H15BrN2O5 MolecularWeight: 419.2261

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)C(=O)OC(C2)C(=O)NC3=C(C=C(C=C3)[N+](=O)[O-])Br

Isomeric SMILES

CCC1=CC2=C(C=C1)C(=O)OC(C2)C(=O)NC3=C(C=C(C=C3)[N+](=O)[O-])Br

InChI

InChI=1S/C18H15BrN2O5/c1-2-10-3-5-13-11(7-10)8-16(26-18(13)23)17(22)20-15-6-4-12(21(24)25)9-14(15)19/h3-7,9,16H,2,8H2,1H3,(H,20,22)