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

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

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