3-[2,2-bis(1-ethyl-2-phenyl-indol-3-yl)ethenyl]-3-[4-(dibutylamino)phenyl]-2-benzofuran-1-one

Systemtic Name: 3-[2,2-bis(1-ethyl-2-phenyl-indol-3-yl)ethenyl]-3-[4-(dibutylamino)phenyl]-2-benzofuran-1-one Openeye Name: 3-[2,2-bis(1-ethyl-2-phenyl-indol-3-yl)vinyl]-3-[4-(dibutylamino)phenyl]isobenzofuran-1-one CAS Name: 3-[2,2-bis(1-ethyl-2-phenyl-3-indolyl)ethenyl]-3-[4-(dibutylamino)phenyl]-1-isobenzofuranone IUPAC Name: 3-[2,2-bis(1-ethyl-2-phenylindol-3-yl)ethenyl]-3-[4-(dibutylamino)phenyl]-2-benzofuran-1-one Traditional Name: 3-[2,2-bis(1-ethyl-2-phenyl-indol-3-yl)vinyl]-3-[4-(dibutylamino)phenyl]phthalide Formula: C56H55N3O2 MolecularWeight: 802.0548

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)C1=CC=C(C=C1)C2(C3=CC=CC=C3C(=O)O2)C=C(C4=C(N(C5=CC=CC=C54)CC)C6=CC=CC=C6)C7=C(N(C8=CC=CC=C87)CC)C9=CC=CC=C9

Isomeric SMILES

CCCCN(CCCC)C1=CC=C(C=C1)C2(C3=CC=CC=C3C(=O)O2)C=C(C4=C(N(C5=CC=CC=C54)CC)C6=CC=CC=C6)C7=C(N(C8=CC=CC=C87)CC)C9=CC=CC=C9

InChI

InChI=1S/C56H55N3O2/c1-5-9-37-57(38-10-6-2)43-35-33-42(34-36-43)56(48-30-20-17-27-44(48)55(60)61-56)39-47(51-45-28-18-21-31-49(45)58(7-3)53(51)40-23-13-11-14-24-40)52-46-29-19-22-32-50(46)59(8-4)54(52)41-25-15-12-16-26-41/h11-36,39H,5-10,37-38H2,1-4H3