methyl 3-[(3-chloranyl-1-benzothiophen-2-yl)-oxidanyl-methyl]-2-methyl-1-benzothiophene-5-carboxylate

Systemtic Name: methyl 3-[(3-chloranyl-1-benzothiophen-2-yl)-oxidanyl-methyl]-2-methyl-1-benzothiophene-5-carboxylate Openeye Name: methyl 3-[(3-chlorobenzothiophen-2-yl)-hydroxy-methyl]-2-methyl-benzothiophene-5-carboxylate CAS Name: 3-[(3-chloro-1-benzothiophen-2-yl)-hydroxymethyl]-2-methyl-1-benzothiophene-5-carboxylic acid methyl ester IUPAC Name: methyl 3-[(3-chloro-1-benzothiophen-2-yl)-hydroxymethyl]-2-methyl-1-benzothiophene-5-carboxylate Traditional Name: 3-[(3-chlorobenzothiophen-2-yl)-hydroxy-methyl]-2-methyl-benzothiophene-5-carboxylic acid methyl ester Formula: C20H15ClO3S2 MolecularWeight: 402.9143

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(S1)C=CC(=C2)C(=O)OC)C(C3=C(C4=CC=CC=C4S3)Cl)O

Isomeric SMILES

CC1=C(C2=C(S1)C=CC(=C2)C(=O)OC)C(C3=C(C4=CC=CC=C4S3)Cl)O

InChI

InChI=1S/C20H15ClO3S2/c1-10-16(13-9-11(20(23)24-2)7-8-15(13)25-10)18(22)19-17(21)12-5-3-4-6-14(12)26-19/h3-9,18,22H,1-2H3