N-[(3,4-dimethoxyphenyl)methyl]-2-[(1-methanoylpiperidin-3-yl)amino]-5-nitro-benzamide

Systemtic Name: N-[(3,4-dimethoxyphenyl)methyl]-2-[(1-methanoylpiperidin-3-yl)amino]-5-nitro-benzamide Openeye Name: N-[(3,4-dimethoxyphenyl)methyl]-2-[(1-formyl-3-piperidyl)amino]-5-nitro-benzamide CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-2-[(1-formyl-3-piperidinyl)amino]-5-nitrobenzamide IUPAC Name: N-[(3,4-dimethoxyphenyl)methyl]-2-[(1-formylpiperidin-3-yl)amino]-5-nitrobenzamide Traditional Name: 2-[(1-formyl-3-piperidyl)amino]-5-nitro-N-veratryl-benzamide Formula: C22H26N4O6 MolecularWeight: 442.46504

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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-])NC3CCCN(C3)C=O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NC3CCCN(C3)C=O)OC

InChI

InChI=1S/C22H26N4O6/c1-31-20-8-5-15(10-21(20)32-2)12-23-22(28)18-11-17(26(29)30)6-7-19(18)24-16-4-3-9-25(13-16)14-27/h5-8,10-11,14,16,24H,3-4,9,12-13H2,1-2H3,(H,23,28)