5-nitro-N-(2-phenylpropyl)-1-benzothiophene-2-carboxamide

Systemtic Name: 5-nitro-N-(2-phenylpropyl)-1-benzothiophene-2-carboxamide Openeye Name: 5-nitro-N-(2-phenylpropyl)benzothiophene-2-carboxamide CAS Name: 5-nitro-N-(2-phenylpropyl)-1-benzothiophene-2-carboxamide IUPAC Name: 5-nitro-N-(2-phenylpropyl)-1-benzothiophene-2-carboxamide Traditional Name: 5-nitro-N-(2-phenylpropyl)benzothiophene-2-carboxamide Formula: C18H16N2O3S MolecularWeight: 340.39624

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)C1=CC2=C(S1)C=CC(=C2)[N+](=O)[O-])C3=CC=CC=C3

Isomeric SMILES

CC(CNC(=O)C1=CC2=C(S1)C=CC(=C2)[N+](=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C18H16N2O3S/c1-12(13-5-3-2-4-6-13)11-19-18(21)17-10-14-9-15(20(22)23)7-8-16(14)24-17/h2-10,12H,11H2,1H3,(H,19,21)