3-(7-chloranylsulfonyl-1-oxidanylidene-phthalazin-2-yl)propanoic acid

Systemtic Name: 3-(7-chloranylsulfonyl-1-oxidanylidene-phthalazin-2-yl)propanoic acid Openeye Name: 3-(7-chlorosulfonyl-1-oxo-phthalazin-2-yl)propanoic acid CAS Name: 3-(7-chlorosulfonyl-1-oxo-2-phthalazinyl)propanoic acid IUPAC Name: 3-(7-chlorosulfonyl-1-oxophthalazin-2-yl)propanoic acid Traditional Name: 3-(7-chlorosulfonyl-1-keto-phthalazin-2-yl)propionic acid Formula: C11H9ClN2O5S MolecularWeight: 316.71756

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1S(=O)(=O)Cl)C(=O)N(N=C2)CCC(=O)O

Isomeric SMILES

C1=CC2=C(C=C1S(=O)(=O)Cl)C(=O)N(N=C2)CCC(=O)O

InChI

InChI=1S/C11H9ClN2O5S/c12-20(18,19)8-2-1-7-6-13-14(4-3-10(15)16)11(17)9(7)5-8/h1-2,5-6H,3-4H2,(H,15,16)