chloranylaluminum; 2-methoxycarbonylbenzoic acid; hydrate

Systemtic Name: chloranylaluminum; 2-methoxycarbonylbenzoic acid; hydrate Openeye Name: chloroaluminum; 2-methoxycarbonylbenzoic acid; hydrate CAS Name: chloroaluminum; 2-methoxycarbonylbenzoic acid; hydrate IUPAC Name: chloroaluminum; 2-methoxycarbonylbenzoic acid; hydrate Traditional Name: 2-carbomethoxybenzoic acid; chloroaluminum; hydrate Formula: C9H10AlClO5 MolecularWeight: 260.607238

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1C(=O)O.O.[Al]Cl

Isomeric SMILES

COC(=O)C1=CC=CC=C1C(=O)O.O.[Al]Cl

InChI

InChI=1S/C9H8O4.Al.ClH.H2O/c1-13-9(12)7-5-3-2-4-6(7)8(10)11;;;/h2-5H,1H3,(H,10,11);;1H;1H2/q;+1;;/p-1