N-(1,3-benzodioxol-5-ylmethyl)-2-[(5-methyl-3-nitro-pyrazol-1-yl)methyl]benzamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(5-methyl-3-nitro-pyrazol-1-yl)methyl]benzamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(5-methyl-3-nitro-pyrazol-1-yl)methyl]benzamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(5-methyl-3-nitro-1-pyrazolyl)methyl]benzamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(5-methyl-3-nitropyrazol-1-yl)methyl]benzamide Traditional Name: 2-[(5-methyl-3-nitro-pyrazol-1-yl)methyl]-N-piperonyl-benzamide Formula: C20H18N4O5 MolecularWeight: 394.38072

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CC2=CC=CC=C2C(=O)NCC3=CC4=C(C=C3)OCO4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=NN1CC2=CC=CC=C2C(=O)NCC3=CC4=C(C=C3)OCO4)[N+](=O)[O-]

InChI

InChI=1S/C20H18N4O5/c1-13-8-19(24(26)27)22-23(13)11-15-4-2-3-5-16(15)20(25)21-10-14-6-7-17-18(9-14)29-12-28-17/h2-9H,10-12H2,1H3,(H,21,25)