(E)-3-[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]-1-(3-nitrophenyl)prop-2-en-1-one

Systemtic Name: (E)-3-[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]-1-(3-nitrophenyl)prop-2-en-1-one Openeye Name: (E)-3-[(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]-1-(3-nitrophenyl)prop-2-en-1-one CAS Name: (E)-3-[(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]-1-(3-nitrophenyl)-2-propen-1-one IUPAC Name: (E)-3-[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]-1-(3-nitrophenyl)prop-2-en-1-one Traditional Name: (E)-3-[(2S)-5-ethoxy-2-methyl-coumaran-6-yl]-1-(3-nitrophenyl)prop-2-en-1-one Formula: C20H19NO5 MolecularWeight: 353.36856

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1C=CC(=O)C3=CC(=CC=C3)[N+](=O)[O-])OC(C2)C

Isomeric SMILES

CCOC1=CC2=C(C=C1/C=C/C(=O)C3=CC(=CC=C3)[N+](=O)[O-])O[C@H](C2)C

InChI

InChI=1S/C20H19NO5/c1-3-25-19-12-16-9-13(2)26-20(16)11-15(19)7-8-18(22)14-5-4-6-17(10-14)21(23)24/h4-8,10-13H,3,9H2,1-2H3/b8-7+/t13-/m0/s1