N-(1,3-benzodioxol-5-ylmethyl)-5-nitro-2-[(2-oxidanylcyclopentyl)amino]benzamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-5-nitro-2-[(2-oxidanylcyclopentyl)amino]benzamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(2-hydroxycyclopentyl)amino]-5-nitro-benzamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(2-hydroxycyclopentyl)amino]-5-nitrobenzamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(2-hydroxycyclopentyl)amino]-5-nitrobenzamide Traditional Name: 2-[(2-hydroxycyclopentyl)amino]-5-nitro-N-piperonyl-benzamide Formula: C20H21N3O6 MolecularWeight: 399.39724

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(C1)O)NC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CC(C(C1)O)NC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H21N3O6/c24-17-3-1-2-16(17)22-15-6-5-13(23(26)27)9-14(15)20(25)21-10-12-4-7-18-19(8-12)29-11-28-18/h4-9,16-17,22,24H,1-3,10-11H2,(H,21,25)