N-[2-(2-bromanyl-4,5-dimethoxy-phenyl)ethyl]-3-nitro-benzamide

Systemtic Name: N-[2-(2-bromanyl-4,5-dimethoxy-phenyl)ethyl]-3-nitro-benzamide Openeye Name: N-[2-(2-bromo-4,5-dimethoxy-phenyl)ethyl]-3-nitro-benzamide CAS Name: N-[2-(2-bromo-4,5-dimethoxyphenyl)ethyl]-3-nitrobenzamide IUPAC Name: N-[2-(2-bromo-4,5-dimethoxyphenyl)ethyl]-3-nitrobenzamide Traditional Name: N-[2-(2-bromo-4,5-dimethoxy-phenyl)ethyl]-3-nitro-benzamide Formula: C17H17BrN2O5 MolecularWeight: 409.23128

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CCNC(=O)C2=CC(=CC=C2)[N+](=O)[O-])Br)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)CCNC(=O)C2=CC(=CC=C2)[N+](=O)[O-])Br)OC

InChI

InChI=1S/C17H17BrN2O5/c1-24-15-9-11(14(18)10-16(15)25-2)6-7-19-17(21)12-4-3-5-13(8-12)20(22)23/h3-5,8-10H,6-7H2,1-2H3,(H,19,21)