copper 1,6-bis(bromanyl)-3-quinolin-8-yloxycarbonyl-naphthalen-2-olate

Systemtic Name: copper 1,6-bis(bromanyl)-3-quinolin-8-yloxycarbonyl-naphthalen-2-olate Openeye Name: copper 1,6-dibromo-3-(8-quinolyloxycarbonyl)naphthalen-2-olate CAS Name: copper 1,6-dibromo-3-[oxo(8-quinolinyloxy)methyl]-2-naphthalenolate IUPAC Name: copper 1,6-dibromo-3-quinolin-8-yloxycarbonylnaphthalen-2-olate Traditional Name: cupric 1,6-dibromo-3-(8-quinolyloxycarbonyl)naphthalen-2-olate Formula: C40H20Br4CuN2O6 MolecularWeight: 1007.7586

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)OC(=O)C3=C(C(=C4C=CC(=CC4=C3)Br)Br)[O-])N=CC=C2.C1=CC2=C(C(=C1)OC(=O)C3=C(C(=C4C=CC(=CC4=C3)Br)Br)[O-])N=CC=C2.[Cu+2]

Isomeric SMILES

C1=CC2=C(C(=C1)OC(=O)C3=C(C(=C4C=CC(=CC4=C3)Br)Br)[O-])N=CC=C2.C1=CC2=C(C(=C1)OC(=O)C3=C(C(=C4C=CC(=CC4=C3)Br)Br)[O-])N=CC=C2.[Cu+2]

InChI

InChI=1S/2C20H11Br2NO3.Cu/c2*21-13-6-7-14-12(9-13)10-15(19(24)17(14)22)20(25)26-16-5-1-3-11-4-2-8-23-18(11)16;/h2*1-10,24H;/q;;+2/p-2