2-methoxy-1,1,3,3-tetramethyl-5-[2-[10-(2-phenylethynyl)anthracen-9-yl]ethynyl]isoindole

Systemtic Name: 2-methoxy-1,1,3,3-tetramethyl-5-[2-[10-(2-phenylethynyl)anthracen-9-yl]ethynyl]isoindole Openeye Name: 2-methoxy-1,1,3,3-tetramethyl-5-[2-[10-(2-phenylethynyl)-9-anthryl]ethynyl]isoindoline CAS Name: 2-methoxy-1,1,3,3-tetramethyl-5-[2-[10-(2-phenylethynyl)-9-anthracenyl]ethynyl]isoindole IUPAC Name: 2-methoxy-1,1,3,3-tetramethyl-5-[2-[10-(2-phenylethynyl)anthracen-9-yl]ethynyl]isoindole Traditional Name: 2-methoxy-1,1,3,3-tetramethyl-5-[2-[10-(2-phenylethynyl)-9-anthryl]ethynyl]isoindoline Formula: C37H31NO MolecularWeight: 505.64814

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=C(C=C(C=C2)C#CC3=C4C=CC=CC4=C(C5=CC=CC=C53)C#CC6=CC=CC=C6)C(N1OC)(C)C)C

Isomeric SMILES

CC1(C2=C(C=C(C=C2)C#CC3=C4C=CC=CC4=C(C5=CC=CC=C53)C#CC6=CC=CC=C6)C(N1OC)(C)C)C

InChI

InChI=1S/C37H31NO/c1-36(2)34-24-21-27(25-35(34)37(3,4)38(36)39-5)20-23-33-30-17-11-9-15-28(30)32(29-16-10-12-18-31(29)33)22-19-26-13-7-6-8-14-26/h6-18,21,24-25H,1-5H3