(2-cyanophenyl)methyl 3-chloranyl-1-benzothiophene-2-carboxylate

Systemtic Name: (2-cyanophenyl)methyl 3-chloranyl-1-benzothiophene-2-carboxylate Openeye Name: (2-cyanophenyl)methyl 3-chlorobenzothiophene-2-carboxylate CAS Name: 3-chloro-1-benzothiophene-2-carboxylic acid (2-cyanophenyl)methyl ester IUPAC Name: (2-cyanophenyl)methyl 3-chloro-1-benzothiophene-2-carboxylate Traditional Name: 3-chlorobenzothiophene-2-carboxylic acid (2-cyanobenzyl) ester Formula: C17H10ClNO2S MolecularWeight: 327.7848

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)COC(=O)C2=C(C3=CC=CC=C3S2)Cl)C#N

Isomeric SMILES

C1=CC=C(C(=C1)COC(=O)C2=C(C3=CC=CC=C3S2)Cl)C#N

InChI

InChI=1S/C17H10ClNO2S/c18-15-13-7-3-4-8-14(13)22-16(15)17(20)21-10-12-6-2-1-5-11(12)9-19/h1-8H,10H2