2-ethylhexyl 3-(1-benzothiophen-3-yl)-3-oxidanylidene-propanoate

Systemtic Name: 2-ethylhexyl 3-(1-benzothiophen-3-yl)-3-oxidanylidene-propanoate Openeye Name: 2-ethylhexyl 3-(benzothiophen-3-yl)-3-oxo-propanoate CAS Name: 3-(1-benzothiophen-3-yl)-3-oxopropanoic acid 2-ethylhexyl ester IUPAC Name: 2-ethylhexyl 3-(1-benzothiophen-3-yl)-3-oxopropanoate Traditional Name: 3-(benzothiophen-3-yl)-3-keto-propionic acid 2-ethylhexyl ester Formula: C19H24O3S MolecularWeight: 332.45706

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)COC(=O)CC(=O)C1=CSC2=CC=CC=C21

Isomeric SMILES

CCCCC(CC)COC(=O)CC(=O)C1=CSC2=CC=CC=C21

InChI

InChI=1S/C19H24O3S/c1-3-5-8-14(4-2)12-22-19(21)11-17(20)16-13-23-18-10-7-6-9-15(16)18/h6-7,9-10,13-14H,3-5,8,11-12H2,1-2H3