4-[(dibutylamino)-phenyl-amino]-5-methyl-spiro[2-benzofuran-3,9'-xanthene]-1-one

Systemtic Name: 4-[(dibutylamino)-phenyl-amino]-5-methyl-spiro[2-benzofuran-3,9'-xanthene]-1-one Openeye Name: 4-(N-(dibutylamino)anilino)-5-methyl-spiro[isobenzofuran-3,9'-xanthene]-1-one CAS Name: 4-(N-(dibutylamino)anilino)-5-methyl-1-spiro[isobenzofuran-3,9'-xanthene]one IUPAC Name: 4-(N-(dibutylamino)anilino)-5-methylspiro[2-benzofuran-3,9'-xanthene]-1-one Traditional Name: 4-(N-(dibutylamino)anilino)-5-methyl-spiro[phthalan-3,9'-xanthene]-1-one Formula: C35H36N2O3 MolecularWeight: 532.67194

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)N(C1=CC=CC=C1)C2=C(C=CC3=C2C4(C5=CC=CC=C5OC6=CC=CC=C64)OC3=O)C

Isomeric SMILES

CCCCN(CCCC)N(C1=CC=CC=C1)C2=C(C=CC3=C2C4(C5=CC=CC=C5OC6=CC=CC=C64)OC3=O)C

InChI

InChI=1S/C35H36N2O3/c1-4-6-23-36(24-7-5-2)37(26-15-9-8-10-16-26)33-25(3)21-22-27-32(33)35(40-34(27)38)28-17-11-13-19-30(28)39-31-20-14-12-18-29(31)35/h8-22H,4-7,23-24H2,1-3H3