5,7-bis(bromanyl)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-id-8-olate; 5,7-bis(bromanyl)-2H-quinolin-1-id-8-olate; indium(3+)

Systemtic Name: 5,7-bis(bromanyl)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-id-8-olate; 5,7-bis(bromanyl)-2H-quinolin-1-id-8-olate; indium(3+) Openeye Name: 5,7-dibromo-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-id-8-olate; 5,7-dibromo-2H-quinolin-1-id-8-olate; indium(3+) CAS Name: 5,7-dibromo-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-id-8-olate; 5,7-dibromo-2H-quinolin-1-id-8-olate; indium(3+) IUPAC Name: 5,7-dibromo-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-id-8-olate; 5,7-dibromo-2H-quinolin-1-id-8-olate; indium(3+) Traditional Name: 5,7-dibromo-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-id-8-olate; 5,7-dibromo-2H-quinolin-1-id-8-olate; indium(3+) Formula: C27H31Br6InN3O3-3 MolecularWeight: 1039.79534

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2C(CC(C(C2[N-]C1)[O-])Br)Br.C1CC2C(CC(C(C2[N-]C1)[O-])Br)Br.C1C=CC2=C([N-]1)C(=C(C=C2Br)Br)[O-].[In+3]

Isomeric SMILES

C1CC2C(CC(C(C2[N-]C1)[O-])Br)Br.C1CC2C(CC(C(C2[N-]C1)[O-])Br)Br.C1C=CC2=C([N-]1)C(=C(C=C2Br)Br)[O-].[In+3]

InChI

InChI=1S/2C9H13Br2NO.C9H6Br2NO.In/c3*10-6-4-7(11)9(13)8-5(6)2-1-3-12-8;/h2*5-9H,1-4H2;1-2,4,13H,3H2;/q2*-2;-1;+3/p-1