2,3,5,6,11,12-hexakis-phenyltetracene-5,12-diol

Systemtic Name: 2,3,5,6,11,12-hexakis-phenyltetracene-5,12-diol Openeye Name: 2,3,5,6,11,12-hexakis-phenyltetracene-5,12-diol CAS Name: 2,3,5,6,11,12-hexakis-phenyltetracene-5,12-diol IUPAC Name: 2,3,5,6,11,12-hexakis-phenyltetracene-5,12-diol Traditional Name: 2,3,5,6,11,12-hexakis-phenyltetracene-5,12-diol Formula: C54H38O2 MolecularWeight: 718.87832

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC3=C(C=C2C4=CC=CC=C4)C(C5=C(C6=CC=CC=C6C(=C5C3(C7=CC=CC=C7)O)C8=CC=CC=C8)C9=CC=CC=C9)(C1=CC=CC=C1)O

Isomeric SMILES

C1=CC=C(C=C1)C2=CC3=C(C=C2C4=CC=CC=C4)C(C5=C(C6=CC=CC=C6C(=C5C3(C7=CC=CC=C7)O)C8=CC=CC=C8)C9=CC=CC=C9)(C1=CC=CC=C1)O

InChI

InChI=1S/C54H38O2/c55-53(41-29-15-5-16-30-41)47-35-45(37-21-7-1-8-22-37)46(38-23-9-2-10-24-38)36-48(47)54(56,42-31-17-6-18-32-42)52-50(40-27-13-4-14-28-40)44-34-20-19-33-43(44)49(51(52)53)39-25-11-3-12-26-39/h1-36,55-56H