4-azanyl-7-[(2,4-dimethylphenyl)-ethyl-amino]spiro[2-benzofuran-3,9'-xanthene]-1-one

Systemtic Name: 4-azanyl-7-[(2,4-dimethylphenyl)-ethyl-amino]spiro[2-benzofuran-3,9'-xanthene]-1-one Openeye Name: 4-amino-7-(N-ethyl-2,4-dimethyl-anilino)spiro[isobenzofuran-3,9'-xanthene]-1-one CAS Name: 4-amino-7-(N-ethyl-2,4-dimethylanilino)-1-spiro[isobenzofuran-3,9'-xanthene]one IUPAC Name: 4-amino-7-(N-ethyl-2,4-dimethylanilino)spiro[2-benzofuran-3,9'-xanthene]-1-one Traditional Name: 4-amino-7-(N-ethyl-2,4-dimethyl-anilino)spiro[phthalan-3,9'-xanthene]-1-one Formula: C30H26N2O3 MolecularWeight: 462.53904

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=C(C=C(C=C1)C)C)C2=C3C(=C(C=C2)N)C4(C5=CC=CC=C5OC6=CC=CC=C64)OC3=O

Isomeric SMILES

CCN(C1=C(C=C(C=C1)C)C)C2=C3C(=C(C=C2)N)C4(C5=CC=CC=C5OC6=CC=CC=C64)OC3=O

InChI

InChI=1S/C30H26N2O3/c1-4-32(23-15-13-18(2)17-19(23)3)24-16-14-22(31)28-27(24)29(33)35-30(28)20-9-5-7-11-25(20)34-26-12-8-6-10-21(26)30/h5-17H,4,31H2,1-3H3