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

Systemtic Name: 4-azanyl-7-[(2,4-dimethylphenyl)-propyl-amino]spiro[2-benzofuran-3,9'-xanthene]-1-one Openeye Name: 4-amino-7-(2,4-dimethyl-N-propyl-anilino)spiro[isobenzofuran-3,9'-xanthene]-1-one CAS Name: 4-amino-7-(2,4-dimethyl-N-propylanilino)-1-spiro[isobenzofuran-3,9'-xanthene]one IUPAC Name: 4-amino-7-(2,4-dimethyl-N-propylanilino)spiro[2-benzofuran-3,9'-xanthene]-1-one Traditional Name: 4-amino-7-(2,4-dimethyl-N-propyl-anilino)spiro[phthalan-3,9'-xanthene]-1-one Formula: C31H28N2O3 MolecularWeight: 476.56562

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(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

CCCN(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/C31H28N2O3/c1-4-17-33(24-15-13-19(2)18-20(24)3)25-16-14-23(32)29-28(25)30(34)36-31(29)21-9-5-7-11-26(21)35-27-12-8-6-10-22(27)31/h5-16,18H,4,17,32H2,1-3H3