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

Systemtic Name: (E)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(3-nitro-4-propan-2-yl-phenyl)prop-2-en-1-one Openeye Name: (E)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(4-isopropyl-3-nitro-phenyl)prop-2-en-1-one CAS Name: (E)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(3-nitro-4-propan-2-ylphenyl)-2-propen-1-one IUPAC Name: (E)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(3-nitro-4-propan-2-ylphenyl)prop-2-en-1-one Traditional Name: (E)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(4-isopropyl-3-nitro-phenyl)prop-2-en-1-one Formula: C20H19NO5 MolecularWeight: 353.36856

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=C(C=C1)C=CC(=O)C2=CC3=C(C=C2)OCCO3)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=C(C=C(C=C1)/C=C/C(=O)C2=CC3=C(C=C2)OCCO3)[N+](=O)[O-]

InChI

InChI=1S/C20H19NO5/c1-13(2)16-6-3-14(11-17(16)21(23)24)4-7-18(22)15-5-8-19-20(12-15)26-10-9-25-19/h3-8,11-13H,9-10H2,1-2H3/b7-4+