2-[9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazol-3-yl]ethyl 3,3-dimethylpentanoate

Systemtic Name: 2-[9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazol-3-yl]ethyl 3,3-dimethylpentanoate Openeye Name: 2-[9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazol-3-yl]ethyl 3,3-dimethylpentanoate CAS Name: 3,3-dimethylpentanoic acid 2-[9-[4-[4-(9-carbazolyl)phenyl]phenyl]-3-carbazolyl]ethyl ester IUPAC Name: 2-[9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazol-3-yl]ethyl 3,3-dimethylpentanoate Traditional Name: 3,3-dimethylvaleric acid 2-[9-[4-(4-carbazol-9-ylphenyl)phenyl]carbazol-3-yl]ethyl ester Formula: C45H40N2O2 MolecularWeight: 640.8113

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)CC(=O)OCCC1=CC2=C(C=C1)N(C3=CC=CC=C32)C4=CC=C(C=C4)C5=CC=C(C=C5)N6C7=CC=CC=C7C8=CC=CC=C86

Isomeric SMILES

CCC(C)(C)CC(=O)OCCC1=CC2=C(C=C1)N(C3=CC=CC=C32)C4=CC=C(C=C4)C5=CC=C(C=C5)N6C7=CC=CC=C7C8=CC=CC=C86

InChI

InChI=1S/C45H40N2O2/c1-4-45(2,3)30-44(48)49-28-27-31-17-26-43-39(29-31)38-13-7-10-16-42(38)47(43)35-24-20-33(21-25-35)32-18-22-34(23-19-32)46-40-14-8-5-11-36(40)37-12-6-9-15-41(37)46/h5-26,29H,4,27-28,30H2,1-3H3