(E)-3-[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]-2-(2-methylfuran-3-yl)carbonyl-prop-2-enenitrile

Systemtic Name: (E)-3-[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]-2-(2-methylfuran-3-yl)carbonyl-prop-2-enenitrile Openeye Name: (E)-3-[(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]-2-(2-methylfuran-3-carbonyl)prop-2-enenitrile CAS Name: (E)-3-[(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]-2-[(2-methyl-3-furanyl)-oxomethyl]-2-propenenitrile IUPAC Name: (E)-3-[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]-2-(2-methylfuran-3-carbonyl)prop-2-enenitrile Traditional Name: (E)-3-[(2S)-5-ethoxy-2-methyl-coumaran-6-yl]-2-(2-methyl-3-furoyl)acrylonitrile Formula: C20H19NO4 MolecularWeight: 337.36916

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1C=C(C#N)C(=O)C3=C(OC=C3)C)OC(C2)C

Isomeric SMILES

CCOC1=CC2=C(C=C1/C=C(\C#N)/C(=O)C3=C(OC=C3)C)O[C@H](C2)C

InChI

InChI=1S/C20H19NO4/c1-4-23-18-9-14-7-12(2)25-19(14)10-15(18)8-16(11-21)20(22)17-5-6-24-13(17)3/h5-6,8-10,12H,4,7H2,1-3H3/b16-8+/t12-/m0/s1