3-bromanyl-4-butoxy-N-(2-methyl-5-nitro-phenyl)benzamide

Systemtic Name: 3-bromanyl-4-butoxy-N-(2-methyl-5-nitro-phenyl)benzamide Openeye Name: 3-bromo-4-butoxy-N-(2-methyl-5-nitro-phenyl)benzamide CAS Name: 3-bromo-4-butoxy-N-(2-methyl-5-nitrophenyl)benzamide IUPAC Name: 3-bromo-4-butoxy-N-(2-methyl-5-nitrophenyl)benzamide Traditional Name: 3-bromo-4-butoxy-N-(2-methyl-5-nitro-phenyl)benzamide Formula: C18H19BrN2O4 MolecularWeight: 407.25846

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])C)Br

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])C)Br

InChI

InChI=1S/C18H19BrN2O4/c1-3-4-9-25-17-8-6-13(10-15(17)19)18(22)20-16-11-14(21(23)24)7-5-12(16)2/h5-8,10-11H,3-4,9H2,1-2H3,(H,20,22)