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(4-cyanophenyl) 6-(butyltrisulfanyl)naphthalene-2-carboxylate

(4-cyanophenyl) 6-(butyltrisulfanyl)naphthalene-2-carboxylate

Systemtic Name:(4-cyanophenyl) 6-(butyltrisulfanyl)naphthalene-2-carboxylate
Openeye Name:(4-cyanophenyl) 6-(butyltrisulfanyl)naphthalene-2-carboxylate
CAS Name:6-(butyltrisulfanyl)-2-naphthalenecarboxylic acid (4-cyanophenyl) ester
IUPAC Name:(4-cyanophenyl) 6-(butyltrisulfanyl)naphthalene-2-carboxylate
Traditional Name:6-(butyltrisulfanyl)naphthalene-2-carboxylic acid (4-cyanophenyl) ester
Formula: C22H19NO2S3
MolecularWeight: 425.58676
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Descriptors Computed from Structure

Canonical SMILES:

CCCCSSSC1=CC2=C(C=C1)C=C(C=C2)C(=O)OC3=CC=C(C=C3)C#N


Isomeric SMILES

CCCCSSSC1=CC2=C(C=C1)C=C(C=C2)C(=O)OC3=CC=C(C=C3)C#N


InChI

InChI=1S/C22H19NO2S3/c1-2-3-12-26-28-27-21-11-8-17-13-19(7-6-18(17)14-21)22(24)25-20-9-4-16(15-23)5-10-20/h4-11,13-14H,2-3,12H2,1H3


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