2-[(E)-2-(7-bromanyl-1,3-benzodioxol-5-yl)ethenyl]-8-nitro-quinoline

Systemtic Name: 2-[(E)-2-(7-bromanyl-1,3-benzodioxol-5-yl)ethenyl]-8-nitro-quinoline Openeye Name: 2-[(E)-2-(7-bromo-1,3-benzodioxol-5-yl)vinyl]-8-nitro-quinoline CAS Name: 2-[(E)-2-(7-bromo-1,3-benzodioxol-5-yl)ethenyl]-8-nitroquinoline IUPAC Name: 2-[(E)-2-(7-bromo-1,3-benzodioxol-5-yl)ethenyl]-8-nitroquinoline Traditional Name: 2-[(E)-2-(7-bromo-1,3-benzodioxol-5-yl)vinyl]-8-nitro-quinoline Formula: C18H11BrN2O4 MolecularWeight: 399.19494

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C(=CC(=C2)C=CC3=NC4=C(C=CC=C4[N+](=O)[O-])C=C3)Br

Isomeric SMILES

C1OC2=C(O1)C(=CC(=C2)/C=C/C3=NC4=C(C=CC=C4[N+](=O)[O-])C=C3)Br

InChI

InChI=1S/C18H11BrN2O4/c19-14-8-11(9-16-18(14)25-10-24-16)4-6-13-7-5-12-2-1-3-15(21(22)23)17(12)20-13/h1-9H,10H2/b6-4+