N-(1,3-benzodioxol-5-ylmethyl)-5-nitro-2-piperidin-1-yl-benzamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-5-nitro-2-piperidin-1-yl-benzamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-5-nitro-2-(1-piperidyl)benzamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-5-nitro-2-(1-piperidinyl)benzamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-5-nitro-2-piperidin-1-ylbenzamide Traditional Name: 5-nitro-2-piperidino-N-piperonyl-benzamide Formula: C20H21N3O5 MolecularWeight: 383.39784

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H21N3O5/c24-20(21-12-14-4-7-18-19(10-14)28-13-27-18)16-11-15(23(25)26)5-6-17(16)22-8-2-1-3-9-22/h4-7,10-11H,1-3,8-9,12-13H2,(H,21,24)