bis(chloranyl)zinc; 4-[2-[(4-oxidanyl-4H-chromen-3-yl)methylideneamino]ethyl]benzenesulfonamide

Systemtic Name: bis(chloranyl)zinc; 4-[2-[(4-oxidanyl-4H-chromen-3-yl)methylideneamino]ethyl]benzenesulfonamide Openeye Name: dichlorozinc; 4-[2-[(4-hydroxy-4H-chromen-3-yl)methyleneamino]ethyl]benzenesulfonamide CAS Name: dichlorozinc; 4-[2-[(4-hydroxy-4H-1-benzopyran-3-yl)methylideneamino]ethyl]benzenesulfonamide IUPAC Name: dichlorozinc; 4-[2-[(4-hydroxy-4H-chromen-3-yl)methylideneamino]ethyl]benzenesulfonamide Traditional Name: dichlorozinc; 4-[2-[(4-hydroxy-4H-chromen-3-yl)methyleneamino]ethyl]benzenesulfonamide Formula: C36H36Cl2N4O8S2Zn MolecularWeight: 853.13804

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(C(=CO2)C=NCCC3=CC=C(C=C3)S(=O)(=O)N)O.C1=CC=C2C(=C1)C(C(=CO2)C=NCCC3=CC=C(C=C3)S(=O)(=O)N)O.Cl[Zn]Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(C(=CO2)C=NCCC3=CC=C(C=C3)S(=O)(=O)N)O.C1=CC=C2C(=C1)C(C(=CO2)C=NCCC3=CC=C(C=C3)S(=O)(=O)N)O.Cl[Zn]Cl

InChI

InChI=1S/2C18H18N2O4S.2ClH.Zn/c2*19-25(22,23)15-7-5-13(6-8-15)9-10-20-11-14-12-24-17-4-2-1-3-16(17)18(14)21;;;/h2*1-8,11-12,18,21H,9-10H2,(H2,19,22,23);2*1H;/q;;;;+2/p-2