phenethyl 3-chloranyl-1-benzothiophene-2-carboxylate

Systemtic Name: phenethyl 3-chloranyl-1-benzothiophene-2-carboxylate Openeye Name: phenethyl 3-chlorobenzothiophene-2-carboxylate CAS Name: 3-chloro-1-benzothiophene-2-carboxylic acid phenethyl ester IUPAC Name: phenethyl 3-chloro-1-benzothiophene-2-carboxylate Traditional Name: 3-chlorobenzothiophene-2-carboxylic acid phenethyl ester Formula: C17H13ClO2S MolecularWeight: 316.80192

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCOC(=O)C2=C(C3=CC=CC=C3S2)Cl

Isomeric SMILES

C1=CC=C(C=C1)CCOC(=O)C2=C(C3=CC=CC=C3S2)Cl

InChI

InChI=1S/C17H13ClO2S/c18-15-13-8-4-5-9-14(13)21-16(15)17(19)20-11-10-12-6-2-1-3-7-12/h1-9H,10-11H2