3-dodecyl-10-methyl-7,14-dihydropentacene-5,12-dione

Systemtic Name: 3-dodecyl-10-methyl-7,14-dihydropentacene-5,12-dione Openeye Name: 3-dodecyl-10-methyl-7,14-dihydropentacene-5,12-dione CAS Name: 3-dodecyl-10-methyl-7,14-dihydropentacene-5,12-dione IUPAC Name: 3-dodecyl-10-methyl-7,14-dihydropentacene-5,12-dione Traditional Name: 3-lauryl-10-methyl-7,14-dihydropentacene-5,12-quinone Formula: C35H40O2 MolecularWeight: 492.6909

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC2=C(CC3=C(C2=O)C=C4CC5=C(C=C(C=C5)C)C(=O)C4=C3)C=C1

Isomeric SMILES

CCCCCCCCCCCCC1=CC2=C(CC3=C(C2=O)C=C4CC5=C(C=C(C=C5)C)C(=O)C4=C3)C=C1

InChI

InChI=1S/C35H40O2/c1-3-4-5-6-7-8-9-10-11-12-13-25-15-17-27-21-29-22-32-28(23-33(29)35(37)31(27)19-25)20-26-16-14-24(2)18-30(26)34(32)36/h14-19,22-23H,3-13,20-21H2,1-2H3