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

Systemtic Name: (E)-3-(4-chloranyl-3-nitro-phenyl)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)prop-2-en-1-one Openeye Name: (E)-3-(4-chloro-3-nitro-phenyl)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)prop-2-en-1-one CAS Name: (E)-3-(4-chloro-3-nitrophenyl)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-propen-1-one IUPAC Name: (E)-3-(4-chloro-3-nitrophenyl)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)prop-2-en-1-one Traditional Name: (E)-3-(4-chloro-3-nitro-phenyl)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)prop-2-en-1-one Formula: C17H12ClNO5 MolecularWeight: 345.73388

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H12ClNO5/c18-13-4-1-11(9-14(13)19(21)22)2-5-15(20)12-3-6-16-17(10-12)24-8-7-23-16/h1-6,9-10H,7-8H2/b5-2+