N-[(3,4-dimethoxyphenyl)methyl]-3,5-dinitro-benzamide

Systemtic Name: N-[(3,4-dimethoxyphenyl)methyl]-3,5-dinitro-benzamide Openeye Name: N-[(3,4-dimethoxyphenyl)methyl]-3,5-dinitro-benzamide CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-3,5-dinitrobenzamide IUPAC Name: N-[(3,4-dimethoxyphenyl)methyl]-3,5-dinitrobenzamide Traditional Name: 3,5-dinitro-N-veratryl-benzamide Formula: C16H15N3O7 MolecularWeight: 361.3062

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15N3O7/c1-25-14-4-3-10(5-15(14)26-2)9-17-16(20)11-6-12(18(21)22)8-13(7-11)19(23)24/h3-8H,9H2,1-2H3,(H,17,20)