(E)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(3-nitro-4-oxidanyl-phenyl)prop-2-en-1-one

Systemtic Name: (E)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(3-nitro-4-oxidanyl-phenyl)prop-2-en-1-one Openeye Name: (E)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(4-hydroxy-3-nitro-phenyl)prop-2-en-1-one CAS Name: (E)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(4-hydroxy-3-nitrophenyl)-2-propen-1-one IUPAC Name: (E)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(4-hydroxy-3-nitrophenyl)prop-2-en-1-one Traditional Name: (E)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(4-hydroxy-3-nitro-phenyl)prop-2-en-1-one Formula: C17H13NO6 MolecularWeight: 327.28822

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)C(=O)C=CC3=CC(=C(C=C3)O)[N+](=O)[O-]

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)C(=O)/C=C/C3=CC(=C(C=C3)O)[N+](=O)[O-]

InChI

InChI=1S/C17H13NO6/c19-14(12-3-6-16-17(10-12)24-8-7-23-16)4-1-11-2-5-15(20)13(9-11)18(21)22/h1-6,9-10,20H,7-8H2/b4-1+