2,7-ditert-butyl-4-[(2,7-ditert-butylpyren-4-yl)oxymethoxy]pyrene

Systemtic Name: 2,7-ditert-butyl-4-[(2,7-ditert-butylpyren-4-yl)oxymethoxy]pyrene Openeye Name: 2,7-ditert-butyl-4-[(2,7-ditert-butylpyren-4-yl)oxymethoxy]pyrene CAS Name: 2,7-ditert-butyl-4-[(2,7-ditert-butyl-4-pyrenyl)oxymethoxy]pyrene IUPAC Name: 2,7-ditert-butyl-4-[(2,7-ditert-butylpyren-4-yl)oxymethoxy]pyrene Traditional Name: 2,7-ditert-butyl-4-[(2,7-ditert-butylpyren-4-yl)oxymethoxy]pyrene Formula: C49H52O2 MolecularWeight: 672.93598

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC2=CC(=C3C=C(C=C4C3=C2C(=C1)C=C4)C(C)(C)C)OCOC5=C6C=C(C=C7C6=C8C(=CC(=CC8=C5)C(C)(C)C)C=C7)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC2=CC(=C3C=C(C=C4C3=C2C(=C1)C=C4)C(C)(C)C)OCOC5=C6C=C(C=C7C6=C8C(=CC(=CC8=C5)C(C)(C)C)C=C7)C(C)(C)C

InChI

InChI=1S/C49H52O2/c1-46(2,3)34-17-28-13-15-30-19-36(48(7,8)9)25-38-40(23-32(21-34)42(28)44(30)38)50-27-51-41-24-33-22-35(47(4,5)6)18-29-14-16-31-20-37(49(10,11)12)26-39(41)45(31)43(29)33/h13-26H,27H2,1-12H3