(E)-3-[(2S)-5-methoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]-1-[(2S)-2-thiophen-2-ylpyrrolidin-1-yl]prop-2-en-1-one

Systemtic Name: (E)-3-[(2S)-5-methoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]-1-[(2S)-2-thiophen-2-ylpyrrolidin-1-yl]prop-2-en-1-one Openeye Name: (E)-3-[(2S)-5-methoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]-1-[(2S)-2-(2-thienyl)pyrrolidin-1-yl]prop-2-en-1-one CAS Name: (E)-3-[(2S)-5-methoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]-1-[(2S)-2-thiophen-2-yl-1-pyrrolidinyl]-2-propen-1-one IUPAC Name: (E)-3-[(2S)-5-methoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]-1-[(2S)-2-thiophen-2-ylpyrrolidin-1-yl]prop-2-en-1-one Traditional Name: (E)-3-[(2S)-5-methoxy-2-methyl-coumaran-6-yl]-1-[(2S)-2-(2-thienyl)pyrrolidino]prop-2-en-1-one Formula: C21H23NO3S MolecularWeight: 369.47722

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=C(O1)C=C(C(=C2)OC)C=CC(=O)N3CCCC3C4=CC=CS4

Isomeric SMILES

C[C@H]1CC2=C(O1)C=C(C(=C2)OC)/C=C/C(=O)N3CCC[C@H]3C4=CC=CS4

InChI

InChI=1S/C21H23NO3S/c1-14-11-16-13-18(24-2)15(12-19(16)25-14)7-8-21(23)22-9-3-5-17(22)20-6-4-10-26-20/h4,6-8,10,12-14,17H,3,5,9,11H2,1-2H3/b8-7+/t14-,17-/m0/s1