(4-cyanophenyl)methyl 3-chloranyl-6-methoxy-1-benzothiophene-2-carboxylate

Systemtic Name: (4-cyanophenyl)methyl 3-chloranyl-6-methoxy-1-benzothiophene-2-carboxylate Openeye Name: (4-cyanophenyl)methyl 3-chloro-6-methoxy-benzothiophene-2-carboxylate CAS Name: 3-chloro-6-methoxy-1-benzothiophene-2-carboxylic acid (4-cyanophenyl)methyl ester IUPAC Name: (4-cyanophenyl)methyl 3-chloro-6-methoxy-1-benzothiophene-2-carboxylate Traditional Name: 3-chloro-6-methoxy-benzothiophene-2-carboxylic acid (4-cyanobenzyl) ester Formula: C18H12ClNO3S MolecularWeight: 357.81078

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=C(S2)C(=O)OCC3=CC=C(C=C3)C#N)Cl

Isomeric SMILES

COC1=CC2=C(C=C1)C(=C(S2)C(=O)OCC3=CC=C(C=C3)C#N)Cl

InChI

InChI=1S/C18H12ClNO3S/c1-22-13-6-7-14-15(8-13)24-17(16(14)19)18(21)23-10-12-4-2-11(9-20)3-5-12/h2-8H,10H2,1H3