N-(1,3-benzodioxol-5-ylmethyl)-3-nitro-4-(4-pyridin-2-ylpiperazin-1-yl)benzamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-3-nitro-4-(4-pyridin-2-ylpiperazin-1-yl)benzamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-3-nitro-4-[4-(2-pyridyl)piperazin-1-yl]benzamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-3-nitro-4-[4-(2-pyridinyl)-1-piperazinyl]benzamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-3-nitro-4-(4-pyridin-2-ylpiperazin-1-yl)benzamide Traditional Name: 3-nitro-N-piperonyl-4-[4-(2-pyridyl)piperazino]benzamide Formula: C24H23N5O5 MolecularWeight: 461.46992

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=C(C=C2)C(=O)NCC3=CC4=C(C=C3)OCO4)[N+](=O)[O-])C5=CC=CC=N5

Isomeric SMILES

C1CN(CCN1C2=C(C=C(C=C2)C(=O)NCC3=CC4=C(C=C3)OCO4)[N+](=O)[O-])C5=CC=CC=N5

InChI

InChI=1S/C24H23N5O5/c30-24(26-15-17-4-7-21-22(13-17)34-16-33-21)18-5-6-19(20(14-18)29(31)32)27-9-11-28(12-10-27)23-3-1-2-8-25-23/h1-8,13-14H,9-12,15-16H2,(H,26,30)