2-methylpropyl 3-[(E)-3-thiophen-2-ylprop-2-enoyl]oxybenzoate

Systemtic Name: 2-methylpropyl 3-[(E)-3-thiophen-2-ylprop-2-enoyl]oxybenzoate Openeye Name: isobutyl 3-[(E)-3-(2-thienyl)prop-2-enoyl]oxybenzoate CAS Name: 3-[(E)-1-oxo-3-thiophen-2-ylprop-2-enoxy]benzoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 3-[(E)-3-thiophen-2-ylprop-2-enoyl]oxybenzoate Traditional Name: 3-[(E)-3-(2-thienyl)acryloyl]oxybenzoic acid isobutyl ester Formula: C18H18O4S MolecularWeight: 330.39812

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)C1=CC(=CC=C1)OC(=O)C=CC2=CC=CS2

Isomeric SMILES

CC(C)COC(=O)C1=CC(=CC=C1)OC(=O)/C=C/C2=CC=CS2

InChI

InChI=1S/C18H18O4S/c1-13(2)12-21-18(20)14-5-3-6-15(11-14)22-17(19)9-8-16-7-4-10-23-16/h3-11,13H,12H2,1-2H3/b9-8+