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

Systemtic Name: 3',6'-bis(dimethylamino)spiro[2-benzofuran-3,9'-xanthene]-1-one; urea Openeye Name: 3',6'-bis(dimethylamino)spiro[isobenzofuran-3,9'-xanthene]-1-one; urea CAS Name: 3',6'-bis(dimethylamino)-1-spiro[isobenzofuran-3,9'-xanthene]one; urea IUPAC Name: 3',6'-bis(dimethylamino)spiro[2-benzofuran-3,9'-xanthene]-1-one; urea Traditional Name: 3',6'-bis(dimethylamino)spiro[phthalan-3,9'-xanthene]-1-one; urea Formula: C25H26N4O4 MolecularWeight: 446.49834

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC2=C(C=C1)C3(C4=C(O2)C=C(C=C4)N(C)C)C5=CC=CC=C5C(=O)O3.C(=O)(N)N

Isomeric SMILES

CN(C)C1=CC2=C(C=C1)C3(C4=C(O2)C=C(C=C4)N(C)C)C5=CC=CC=C5C(=O)O3.C(=O)(N)N

InChI

InChI=1S/C24H22N2O3.CH4N2O/c1-25(2)15-9-11-19-21(13-15)28-22-14-16(26(3)4)10-12-20(22)24(19)18-8-6-5-7-17(18)23(27)29-24;2-1(3)4/h5-14H,1-4H3;(H4,2,3,4)