3,5,5-tris(6-chloranyl-2-phenyl-1H-indol-3-yl)furan-2-one

Systemtic Name: 3,5,5-tris(6-chloranyl-2-phenyl-1H-indol-3-yl)furan-2-one Openeye Name: 3,5,5-tris(6-chloro-2-phenyl-1H-indol-3-yl)furan-2-one CAS Name: 3,5,5-tris(6-chloro-2-phenyl-1H-indol-3-yl)-2-furanone IUPAC Name: 3,5,5-tris(6-chloro-2-phenyl-1H-indol-3-yl)furan-2-one Traditional Name: 3,5,5-tris(6-chloro-2-phenyl-1H-indol-3-yl)furan-2-one Formula: C46H28Cl3N3O2 MolecularWeight: 761.09242

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C3=C(N2)C=C(C=C3)Cl)C4=CC(OC4=O)(C5=C(NC6=C5C=CC(=C6)Cl)C7=CC=CC=C7)C8=C(NC9=C8C=CC(=C9)Cl)C1=CC=CC=C1

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C3=C(N2)C=C(C=C3)Cl)C4=CC(OC4=O)(C5=C(NC6=C5C=CC(=C6)Cl)C7=CC=CC=C7)C8=C(NC9=C8C=CC(=C9)Cl)C1=CC=CC=C1

InChI

InChI=1S/C46H28Cl3N3O2/c47-29-16-19-32-36(22-29)50-42(26-10-4-1-5-11-26)39(32)35-25-46(54-45(35)53,40-33-20-17-30(48)23-37(33)51-43(40)27-12-6-2-7-13-27)41-34-21-18-31(49)24-38(34)52-44(41)28-14-8-3-9-15-28/h1-25,50-52H