5-nitro-N-[[4-(oxolan-2-ylmethoxy)phenyl]methyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 5-nitro-N-[[4-(oxolan-2-ylmethoxy)phenyl]methyl]-1-benzothiophene-2-carboxamide Openeye Name: 5-nitro-N-[[4-(tetrahydrofuran-2-ylmethoxy)phenyl]methyl]benzothiophene-2-carboxamide CAS Name: 5-nitro-N-[[4-(2-oxolanylmethoxy)phenyl]methyl]-1-benzothiophene-2-carboxamide IUPAC Name: 5-nitro-N-[[4-(oxolan-2-ylmethoxy)phenyl]methyl]-1-benzothiophene-2-carboxamide Traditional Name: 5-nitro-N-[4-(tetrahydrofurfuryloxy)benzyl]benzothiophene-2-carboxamide Formula: C21H20N2O5S MolecularWeight: 412.4589

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)COC2=CC=C(C=C2)CNC(=O)C3=CC4=C(S3)C=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

C1CC(OC1)COC2=CC=C(C=C2)CNC(=O)C3=CC4=C(S3)C=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H20N2O5S/c24-21(20-11-15-10-16(23(25)26)5-8-19(15)29-20)22-12-14-3-6-17(7-4-14)28-13-18-2-1-9-27-18/h3-8,10-11,18H,1-2,9,12-13H2,(H,22,24)