2-bromanyl-N-[(3,4-dimethoxyphenyl)methyl]-5-nitro-benzamide

Systemtic Name: 2-bromanyl-N-[(3,4-dimethoxyphenyl)methyl]-5-nitro-benzamide Openeye Name: 2-bromo-N-[(3,4-dimethoxyphenyl)methyl]-5-nitro-benzamide CAS Name: 2-bromo-N-[(3,4-dimethoxyphenyl)methyl]-5-nitrobenzamide IUPAC Name: 2-bromo-N-[(3,4-dimethoxyphenyl)methyl]-5-nitrobenzamide Traditional Name: 2-bromo-5-nitro-N-veratryl-benzamide Formula: C16H15BrN2O5 MolecularWeight: 395.2047

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15BrN2O5/c1-23-14-6-3-10(7-15(14)24-2)9-18-16(20)12-8-11(19(21)22)4-5-13(12)17/h3-8H,9H2,1-2H3,(H,18,20)