N-(2-bromanyl-4-nitro-phenyl)-4-(2,3-dimethylphenoxy)butanamide

Systemtic Name: N-(2-bromanyl-4-nitro-phenyl)-4-(2,3-dimethylphenoxy)butanamide Openeye Name: N-(2-bromo-4-nitro-phenyl)-4-(2,3-dimethylphenoxy)butanamide CAS Name: N-(2-bromo-4-nitrophenyl)-4-(2,3-dimethylphenoxy)butanamide IUPAC Name: N-(2-bromo-4-nitrophenyl)-4-(2,3-dimethylphenoxy)butanamide Traditional Name: N-(2-bromo-4-nitro-phenyl)-4-(2,3-dimethylphenoxy)butyramide Formula: C18H19BrN2O4 MolecularWeight: 407.25846

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)OCCCC(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])Br)C

Isomeric SMILES

CC1=C(C(=CC=C1)OCCCC(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])Br)C

InChI

InChI=1S/C18H19BrN2O4/c1-12-5-3-6-17(13(12)2)25-10-4-7-18(22)20-16-9-8-14(21(23)24)11-15(16)19/h3,5-6,8-9,11H,4,7,10H2,1-2H3,(H,20,22)