4-[(3-chloranyl-1-benzothiophen-2-yl)carbonyloxy]but-2-ynyl 3-chloranyl-1-benzothiophene-2-carboxylate

Systemtic Name: 4-[(3-chloranyl-1-benzothiophen-2-yl)carbonyloxy]but-2-ynyl 3-chloranyl-1-benzothiophene-2-carboxylate Openeye Name: 4-(3-chlorobenzothiophene-2-carbonyl)oxybut-2-ynyl 3-chlorobenzothiophene-2-carboxylate CAS Name: 3-chloro-1-benzothiophene-2-carboxylic acid 4-[(3-chloro-1-benzothiophen-2-yl)-oxomethoxy]but-2-ynyl ester IUPAC Name: 4-(3-chloro-1-benzothiophene-2-carbonyl)oxybut-2-ynyl 3-chloro-1-benzothiophene-2-carboxylate Traditional Name: 3-chlorobenzothiophene-2-carboxylic acid 4-(3-chlorobenzothiophene-2-carbonyl)oxybut-2-ynyl ester Formula: C22H12Cl2O4S2 MolecularWeight: 475.36428

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(S2)C(=O)OCC#CCOC(=O)C3=C(C4=CC=CC=C4S3)Cl)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(S2)C(=O)OCC#CCOC(=O)C3=C(C4=CC=CC=C4S3)Cl)Cl

InChI

InChI=1S/C22H12Cl2O4S2/c23-17-13-7-1-3-9-15(13)29-19(17)21(25)27-11-5-6-12-28-22(26)20-18(24)14-8-2-4-10-16(14)30-20/h1-4,7-10H,11-12H2