3',6'-bis(aminomethylamino)spiro[2-benzofuran-3,9'-xanthene]-1-one

Systemtic Name: 3',6'-bis(aminomethylamino)spiro[2-benzofuran-3,9'-xanthene]-1-one Openeye Name: 3',6'-bis(aminomethylamino)spiro[isobenzofuran-3,9'-xanthene]-1-one CAS Name: 3',6'-bis(aminomethylamino)-1-spiro[isobenzofuran-3,9'-xanthene]one IUPAC Name: 3',6'-bis(aminomethylamino)spiro[2-benzofuran-3,9'-xanthene]-1-one Traditional Name: 3',6'-bis(aminomethylamino)spiro[phthalan-3,9'-xanthene]-1-one Formula: C22H20N4O3 MolecularWeight: 388.4192

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)OC23C4=C(C=C(C=C4)NCN)OC5=C3C=CC(=C5)NCN

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)OC23C4=C(C=C(C=C4)NCN)OC5=C3C=CC(=C5)NCN

InChI

InChI=1S/C22H20N4O3/c23-11-25-13-5-7-17-19(9-13)28-20-10-14(26-12-24)6-8-18(20)22(17)16-4-2-1-3-15(16)21(27)29-22/h1-10,25-26H,11-12,23-24H2