14H-benzo[b]triphenylen-9-one; 7,7-dimethyloctanoic acid

Systemtic Name: 14H-benzo[b]triphenylen-9-one; 7,7-dimethyloctanoic acid Openeye Name: 14H-benzo[b]triphenylen-9-one; 7,7-dimethyloctanoic acid CAS Name: 14H-benzo[b]triphenylen-9-one; 7,7-dimethyloctanoic acid IUPAC Name: 14H-benzo[b]triphenylen-9-one; 7,7-dimethyloctanoic acid Traditional Name: 14H-benzo[b]triphenylen-9-one; 7,7-dimethylcaprylic acid Formula: C32H34O3 MolecularWeight: 466.61056

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CCCCCC(=O)O.C1C2=CC=CC=C2C(=O)C3=C1C4=CC=CC=C4C5=CC=CC=C53

Isomeric SMILES

CC(C)(C)CCCCCC(=O)O.C1C2=CC=CC=C2C(=O)C3=C1C4=CC=CC=C4C5=CC=CC=C53

InChI

InChI=1S/C22H14O.C10H20O2/c23-22-15-8-2-1-7-14(15)13-20-18-11-4-3-9-16(18)17-10-5-6-12-19(17)21(20)22;1-10(2,3)8-6-4-5-7-9(11)12/h1-12H,13H2;4-8H2,1-3H3,(H,11,12)