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octacosyl 1-benzothiophene-2-carboxylate

octacosyl 1-benzothiophene-2-carboxylate

Systemtic Name:octacosyl 1-benzothiophene-2-carboxylate
Openeye Name:octacosyl benzothiophene-2-carboxylate
CAS Name:1-benzothiophene-2-carboxylic acid octacosyl ester
IUPAC Name:octacosyl 1-benzothiophene-2-carboxylate
Traditional Name:benzothiophene-2-carboxylic acid montanyl ester
Formula: C37H62O2S
MolecularWeight: 570.95198
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCCCCCCCCOC(=O)C1=CC2=CC=CC=C2S1


Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCCCCCCCCOC(=O)C1=CC2=CC=CC=C2S1


InChI

InChI=1S/C37H62O2S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-29-32-39-37(38)36-33-34-30-27-28-31-35(34)40-36/h27-28,30-31,33H,2-26,29,32H2,1H3


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