N-[(2,5-dimethoxyphenyl)methyl]-5-nitro-2-piperidin-1-yl-benzamide

Systemtic Name: N-[(2,5-dimethoxyphenyl)methyl]-5-nitro-2-piperidin-1-yl-benzamide Openeye Name: N-[(2,5-dimethoxyphenyl)methyl]-5-nitro-2-(1-piperidyl)benzamide CAS Name: N-[(2,5-dimethoxyphenyl)methyl]-5-nitro-2-(1-piperidinyl)benzamide IUPAC Name: N-[(2,5-dimethoxyphenyl)methyl]-5-nitro-2-piperidin-1-ylbenzamide Traditional Name: N-(2,5-dimethoxybenzyl)-5-nitro-2-piperidino-benzamide Formula: C21H25N3O5 MolecularWeight: 399.4403

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)CNC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCCCC3

Isomeric SMILES

COC1=CC(=C(C=C1)OC)CNC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCCCC3

InChI

InChI=1S/C21H25N3O5/c1-28-17-7-9-20(29-2)15(12-17)14-22-21(25)18-13-16(24(26)27)6-8-19(18)23-10-4-3-5-11-23/h6-9,12-13H,3-5,10-11,14H2,1-2H3,(H,22,25)