3,6,6-trimethyl-4-oxidanylidene-N-(2-thiophen-2-ylethyl)-5,7-dihydro-1-benzofuran-2-carboxamide

Systemtic Name: 3,6,6-trimethyl-4-oxidanylidene-N-(2-thiophen-2-ylethyl)-5,7-dihydro-1-benzofuran-2-carboxamide Openeye Name: 3,6,6-trimethyl-4-oxo-N-[2-(2-thienyl)ethyl]-5,7-dihydrobenzofuran-2-carboxamide CAS Name: 3,6,6-trimethyl-4-oxo-N-(2-thiophen-2-ylethyl)-5,7-dihydrobenzofuran-2-carboxamide IUPAC Name: 3,6,6-trimethyl-4-oxo-N-(2-thiophen-2-ylethyl)-5,7-dihydro-1-benzofuran-2-carboxamide Traditional Name: 4-keto-3,6,6-trimethyl-N-[2-(2-thienyl)ethyl]-5,7-dihydrobenzofuran-2-carboxamide Formula: C18H21NO3S MolecularWeight: 331.42924

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C(=O)CC(C2)(C)C)C(=O)NCCC3=CC=CS3

Isomeric SMILES

CC1=C(OC2=C1C(=O)CC(C2)(C)C)C(=O)NCCC3=CC=CS3

InChI

InChI=1S/C18H21NO3S/c1-11-15-13(20)9-18(2,3)10-14(15)22-16(11)17(21)19-7-6-12-5-4-8-23-12/h4-5,8H,6-7,9-10H2,1-3H3,(H,19,21)