N-(2-bromanyl-4-nitro-phenyl)-3-methyl-1-oxidanylidene-6-propan-2-yl-4H-isochromene-3-carboxamide

Systemtic Name: N-(2-bromanyl-4-nitro-phenyl)-3-methyl-1-oxidanylidene-6-propan-2-yl-4H-isochromene-3-carboxamide Openeye Name: N-(2-bromo-4-nitro-phenyl)-6-isopropyl-3-methyl-1-oxo-isochromane-3-carboxamide CAS Name: N-(2-bromo-4-nitrophenyl)-3-methyl-1-oxo-6-propan-2-yl-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: N-(2-bromo-4-nitrophenyl)-3-methyl-1-oxo-6-propan-2-yl-4H-isochromene-3-carboxamide Traditional Name: N-(2-bromo-4-nitro-phenyl)-6-isopropyl-1-keto-3-methyl-isochroman-3-carboxamide Formula: C20H19BrN2O5 MolecularWeight: 447.27926

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H19BrN2O5/c1-11(2)12-4-6-15-13(8-12)10-20(3,28-18(15)24)19(25)22-17-7-5-14(23(26)27)9-16(17)21/h4-9,11H,10H2,1-3H3,(H,22,25)