N-[3-(4-ethoxyphenoxy)-5-nitro-phenyl]-2-prop-2-enylsulfanyl-ethanamide

Systemtic Name: N-[3-(4-ethoxyphenoxy)-5-nitro-phenyl]-2-prop-2-enylsulfanyl-ethanamide Openeye Name: 2-allylsulfanyl-N-[3-(4-ethoxyphenoxy)-5-nitro-phenyl]acetamide CAS Name: N-[3-(4-ethoxyphenoxy)-5-nitrophenyl]-2-(prop-2-enylthio)acetamide IUPAC Name: N-[3-(4-ethoxyphenoxy)-5-nitrophenyl]-2-prop-2-enylsulfanylacetamide Traditional Name: 2-(allylthio)-N-[3-(4-ethoxyphenoxy)-5-nitro-phenyl]acetamide Formula: C19H20N2O5S MolecularWeight: 388.4375

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)CSCC=C

Isomeric SMILES

CCOC1=CC=C(C=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)CSCC=C

InChI

InChI=1S/C19H20N2O5S/c1-3-9-27-13-19(22)20-14-10-15(21(23)24)12-18(11-14)26-17-7-5-16(6-8-17)25-4-2/h3,5-8,10-12H,1,4,9,13H2,2H3,(H,20,22)