5-nitro-2-piperidin-1-yl-N-(3,4,5-trimethoxyphenyl)benzamide

Systemtic Name: 5-nitro-2-piperidin-1-yl-N-(3,4,5-trimethoxyphenyl)benzamide Openeye Name: 5-nitro-2-(1-piperidyl)-N-(3,4,5-trimethoxyphenyl)benzamide CAS Name: 5-nitro-2-(1-piperidinyl)-N-(3,4,5-trimethoxyphenyl)benzamide IUPAC Name: 5-nitro-2-piperidin-1-yl-N-(3,4,5-trimethoxyphenyl)benzamide Traditional Name: 5-nitro-2-piperidino-N-(3,4,5-trimethoxyphenyl)benzamide Formula: C21H25N3O6 MolecularWeight: 415.4397

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCCCC3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCCCC3

InChI

InChI=1S/C21H25N3O6/c1-28-18-11-14(12-19(29-2)20(18)30-3)22-21(25)16-13-15(24(26)27)7-8-17(16)23-9-5-4-6-10-23/h7-8,11-13H,4-6,9-10H2,1-3H3,(H,22,25)