calcium 5-chloranylquinolin-8-olate

Systemtic Name: calcium 5-chloranylquinolin-8-olate Openeye Name: calcium 5-chloroquinolin-8-olate CAS Name: calcium 5-chloro-8-quinolinolate IUPAC Name: calcium 5-chloroquinolin-8-olate Traditional Name: calcium 5-chloroquinolin-8-olate Formula: C18H10CaCl2N2O2 MolecularWeight: 397.2682

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC(=C2N=C1)[O-])Cl.C1=CC2=C(C=CC(=C2N=C1)[O-])Cl.[Ca+2]

Isomeric SMILES

C1=CC2=C(C=CC(=C2N=C1)[O-])Cl.C1=CC2=C(C=CC(=C2N=C1)[O-])Cl.[Ca+2]

InChI

InChI=1S/2C9H6ClNO.Ca/c2*10-7-3-4-8(12)9-6(7)2-1-5-11-9;/h2*1-5,12H;/q;;+2/p-2