3-(1-azanylethyl)-6,7-bis(oxidanyl)-3H-2-benzofuran-1-one hydrobromide

Systemtic Name: 3-(1-azanylethyl)-6,7-bis(oxidanyl)-3H-2-benzofuran-1-one hydrobromide Openeye Name: 3-(1-aminoethyl)-6,7-dihydroxy-3H-isobenzofuran-1-one hydrobromide CAS Name: 3-(1-aminoethyl)-6,7-dihydroxy-3H-isobenzofuran-1-one hydrobromide IUPAC Name: 3-(1-aminoethyl)-6,7-dihydroxy-3H-2-benzofuran-1-one hydrobromide Traditional Name: 3-(1-aminoethyl)-6,7-dihydroxy-phthalide hydrobromide Formula: C10H12BrNO4 MolecularWeight: 290.11058

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1C2=C(C(=C(C=C2)O)O)C(=O)O1)N.Br

Isomeric SMILES

CC(C1C2=C(C(=C(C=C2)O)O)C(=O)O1)N.Br

InChI

InChI=1S/C10H11NO4.BrH/c1-4(11)9-5-2-3-6(12)8(13)7(5)10(14)15-9;/h2-4,9,12-13H,11H2,1H3;1H