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

Systemtic Name: 5-chloranyl-4-[(dipentylamino)-phenyl-amino]spiro[2-benzofuran-3,9'-xanthene]-1-one Openeye Name: 5-chloro-4-(N-(dipentylamino)anilino)spiro[isobenzofuran-3,9'-xanthene]-1-one CAS Name: 5-chloro-4-(N-(dipentylamino)anilino)-1-spiro[isobenzofuran-3,9'-xanthene]one IUPAC Name: 5-chloro-4-(N-(dipentylamino)anilino)spiro[2-benzofuran-3,9'-xanthene]-1-one Traditional Name: 5-chloro-4-(N-(diamylamino)anilino)spiro[phthalan-3,9'-xanthene]-1-one Formula: C36H37ClN2O3 MolecularWeight: 581.14358

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CCCCC)N(C1=CC=CC=C1)C2=C(C=CC3=C2C4(C5=CC=CC=C5OC6=CC=CC=C64)OC3=O)Cl

Isomeric SMILES

CCCCCN(CCCCC)N(C1=CC=CC=C1)C2=C(C=CC3=C2C4(C5=CC=CC=C5OC6=CC=CC=C64)OC3=O)Cl

InChI

InChI=1S/C36H37ClN2O3/c1-3-5-14-24-38(25-15-6-4-2)39(26-16-8-7-9-17-26)34-30(37)23-22-27-33(34)36(42-35(27)40)28-18-10-12-20-31(28)41-32-21-13-11-19-29(32)36/h7-13,16-23H,3-6,14-15,24-25H2,1-2H3