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

Systemtic Name: 7-[(2,4-dimethylphenyl)-ethyl-amino]-4-[(phenylmethyl)amino]spiro[2-benzofuran-3,9'-xanthene]-1-one Openeye Name: 4-(benzylamino)-7-(N-ethyl-2,4-dimethyl-anilino)spiro[isobenzofuran-3,9'-xanthene]-1-one CAS Name: 7-(N-ethyl-2,4-dimethylanilino)-4-[(phenylmethyl)amino]-1-spiro[isobenzofuran-3,9'-xanthene]one IUPAC Name: 4-(benzylamino)-7-(N-ethyl-2,4-dimethylanilino)spiro[2-benzofuran-3,9'-xanthene]-1-one Traditional Name: 4-(benzylamino)-7-(N-ethyl-2,4-dimethyl-anilino)spiro[phthalan-3,9'-xanthene]-1-one Formula: C37H32N2O3 MolecularWeight: 552.66158

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=C(C=C(C=C1)C)C)C2=C3C(=C(C=C2)NCC4=CC=CC=C4)C5(C6=CC=CC=C6OC7=CC=CC=C75)OC3=O

Isomeric SMILES

CCN(C1=C(C=C(C=C1)C)C)C2=C3C(=C(C=C2)NCC4=CC=CC=C4)C5(C6=CC=CC=C6OC7=CC=CC=C75)OC3=O

InChI

InChI=1S/C37H32N2O3/c1-4-39(30-20-18-24(2)22-25(30)3)31-21-19-29(38-23-26-12-6-5-7-13-26)35-34(31)36(40)42-37(35)27-14-8-10-16-32(27)41-33-17-11-9-15-28(33)37/h5-22,38H,4,23H2,1-3H3