N-[4-[3-(3-nitrophenoxy)-2-oxidanyl-propoxy]phenyl]thiophene-2-carboxamide

Systemtic Name: N-[4-[3-(3-nitrophenoxy)-2-oxidanyl-propoxy]phenyl]thiophene-2-carboxamide Openeye Name: N-[4-[2-hydroxy-3-(3-nitrophenoxy)propoxy]phenyl]thiophene-2-carboxamide CAS Name: N-[4-[2-hydroxy-3-(3-nitrophenoxy)propoxy]phenyl]-2-thiophenecarboxamide IUPAC Name: N-[4-[2-hydroxy-3-(3-nitrophenoxy)propoxy]phenyl]thiophene-2-carboxamide Traditional Name: N-[4-[2-hydroxy-3-(3-nitrophenoxy)propoxy]phenyl]thiophene-2-carboxamide Formula: C20H18N2O6S MolecularWeight: 414.43172

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OCC(COC2=CC=C(C=C2)NC(=O)C3=CC=CS3)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)OCC(COC2=CC=C(C=C2)NC(=O)C3=CC=CS3)O)[N+](=O)[O-]

InChI

InChI=1S/C20H18N2O6S/c23-16(13-28-18-4-1-3-15(11-18)22(25)26)12-27-17-8-6-14(7-9-17)21-20(24)19-5-2-10-29-19/h1-11,16,23H,12-13H2,(H,21,24)