N-(1,3-benzodioxol-5-ylmethyl)-N-cyclopentyl-5-nitro-1-benzothiophene-2-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-N-cyclopentyl-5-nitro-1-benzothiophene-2-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-N-cyclopentyl-5-nitro-benzothiophene-2-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-N-cyclopentyl-5-nitro-1-benzothiophene-2-carboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-N-cyclopentyl-5-nitro-1-benzothiophene-2-carboxamide Traditional Name: N-cyclopentyl-5-nitro-N-piperonyl-benzothiophene-2-carboxamide Formula: C22H20N2O5S MolecularWeight: 424.4696

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N(CC2=CC3=C(C=C2)OCO3)C(=O)C4=CC5=C(S4)C=CC(=C5)[N+](=O)[O-]

Isomeric SMILES

C1CCC(C1)N(CC2=CC3=C(C=C2)OCO3)C(=O)C4=CC5=C(S4)C=CC(=C5)[N+](=O)[O-]

InChI

InChI=1S/C22H20N2O5S/c25-22(21-11-15-10-17(24(26)27)6-8-20(15)30-21)23(16-3-1-2-4-16)12-14-5-7-18-19(9-14)29-13-28-18/h5-11,16H,1-4,12-13H2