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(3-cyanophenyl)methyl 6-methyl-2,3-dihydro-1-benzothiophene-2-carboxylate

(3-cyanophenyl)methyl 6-methyl-2,3-dihydro-1-benzothiophene-2-carboxylate

Systemtic Name:(3-cyanophenyl)methyl 6-methyl-2,3-dihydro-1-benzothiophene-2-carboxylate
Openeye Name:(3-cyanophenyl)methyl 6-methyl-2,3-dihydrobenzothiophene-2-carboxylate
CAS Name:6-methyl-2,3-dihydro-1-benzothiophene-2-carboxylic acid (3-cyanophenyl)methyl ester
IUPAC Name:(3-cyanophenyl)methyl 6-methyl-2,3-dihydro-1-benzothiophene-2-carboxylate
Traditional Name:6-methyl-2,3-dihydrobenzothiophene-2-carboxylic acid (3-cyanobenzyl) ester
Formula: C18H15NO2S
MolecularWeight: 309.3822
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(CC(S2)C(=O)OCC3=CC=CC(=C3)C#N)C=C1


Isomeric SMILES

CC1=CC2=C(CC(S2)C(=O)OCC3=CC=CC(=C3)C#N)C=C1


InChI

InChI=1S/C18H15NO2S/c1-12-5-6-15-9-17(22-16(15)7-12)18(20)21-11-14-4-2-3-13(8-14)10-19/h2-8,17H,9,11H2,1H3


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