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pentacene-1-sulfonic acid

pentacene-1-sulfonic acid

Systemtic Name:pentacene-1-sulfonic acid
Openeye Name:pentacene-1-sulfonic acid
CAS Name:1-pentacenesulfonic acid
IUPAC Name:pentacene-1-sulfonic acid
Traditional Name:pentacene-1-sulfonic acid
Formula: C22H14O3S
MolecularWeight: 358.40976
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C3C=C4C=C5C(=CC4=CC3=CC2=C1)C=CC=C5S(=O)(=O)O


Isomeric SMILES

C1=CC=C2C=C3C=C4C=C5C(=CC4=CC3=CC2=C1)C=CC=C5S(=O)(=O)O


InChI

InChI=1S/C22H14O3S/c23-26(24,25)22-7-3-6-16-10-19-11-17-8-14-4-1-2-5-15(14)9-18(17)12-20(19)13-21(16)22/h1-13H,(H,23,24,25)


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