methyl 2-[[5-(5-chloranylpentanoyl)thiophen-2-yl]methyl]benzoate

Systemtic Name: methyl 2-[[5-(5-chloranylpentanoyl)thiophen-2-yl]methyl]benzoate Openeye Name: methyl 2-[[5-(5-chloropentanoyl)-2-thienyl]methyl]benzoate CAS Name: 2-[[5-(5-chloro-1-oxopentyl)-2-thiophenyl]methyl]benzoic acid methyl ester IUPAC Name: methyl 2-[[5-(5-chloropentanoyl)thiophen-2-yl]methyl]benzoate Traditional Name: 2-[[5-(5-chloropentanoyl)-2-thienyl]methyl]benzoic acid methyl ester Formula: C18H19ClO3S MolecularWeight: 350.85966

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1CC2=CC=C(S2)C(=O)CCCCCl

Isomeric SMILES

COC(=O)C1=CC=CC=C1CC2=CC=C(S2)C(=O)CCCCCl

InChI

InChI=1S/C18H19ClO3S/c1-22-18(21)15-7-3-2-6-13(15)12-14-9-10-17(23-14)16(20)8-4-5-11-19/h2-3,6-7,9-10H,4-5,8,11-12H2,1H3