[5-(3-methoxy-7-oxidanylidene-chromen-2-yl)-2-oxidanyl-phenoxy]aluminum(2+) dichloride

Systemtic Name: [5-(3-methoxy-7-oxidanylidene-chromen-2-yl)-2-oxidanyl-phenoxy]aluminum(2+) dichloride Openeye Name: [2-hydroxy-5-(3-methoxy-7-oxo-chromen-2-yl)phenoxy]aluminum(2+) dichloride CAS Name: [2-hydroxy-5-(3-methoxy-7-oxo-1-benzopyran-2-yl)phenoxy]aluminum(2+) dichloride IUPAC Name: [2-hydroxy-5-(3-methoxy-7-oxochromen-2-yl)phenoxy]aluminum(2+) dichloride Traditional Name: [2-hydroxy-5-(7-keto-3-methoxy-chromen-2-yl)phenoxy]aluminum(2+) dichloride Formula: C16H11AlCl2O5 MolecularWeight: 381.143078

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(OC2=CC(=O)C=CC2=C1)C3=CC(=C(C=C3)O)O[Al+2].[Cl-].[Cl-]

Isomeric SMILES

COC1=C(OC2=CC(=O)C=CC2=C1)C3=CC(=C(C=C3)O)O[Al+2].[Cl-].[Cl-]

InChI

InChI=1S/C16H12O5.Al.2ClH/c1-20-15-7-9-2-4-11(17)8-14(9)21-16(15)10-3-5-12(18)13(19)6-10;;;/h2-8,18-19H,1H3;;2*1H/q;+3;;/p-3