(E)-3-(6-nitro-1,3-benzodioxol-5-yl)-1-(3-pyrrol-1-ylphenyl)prop-2-en-1-one

Systemtic Name: (E)-3-(6-nitro-1,3-benzodioxol-5-yl)-1-(3-pyrrol-1-ylphenyl)prop-2-en-1-one Openeye Name: (E)-3-(6-nitro-1,3-benzodioxol-5-yl)-1-(3-pyrrol-1-ylphenyl)prop-2-en-1-one CAS Name: (E)-3-(6-nitro-1,3-benzodioxol-5-yl)-1-[3-(1-pyrrolyl)phenyl]-2-propen-1-one IUPAC Name: (E)-3-(6-nitro-1,3-benzodioxol-5-yl)-1-(3-pyrrol-1-ylphenyl)prop-2-en-1-one Traditional Name: (E)-3-(6-nitro-1,3-benzodioxol-5-yl)-1-(3-pyrrol-1-ylphenyl)prop-2-en-1-one Formula: C20H14N2O5 MolecularWeight: 362.33556

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)C=CC(=O)C3=CC(=CC=C3)N4C=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)/C=C/C(=O)C3=CC(=CC=C3)N4C=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H14N2O5/c23-18(15-4-3-5-16(10-15)21-8-1-2-9-21)7-6-14-11-19-20(27-13-26-19)12-17(14)22(24)25/h1-12H,13H2/b7-6+