N'-[(E)-3-[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]prop-2-enoyl]-4-nitro-benzohydrazide

Systemtic Name: N'-[(E)-3-[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]prop-2-enoyl]-4-nitro-benzohydrazide Openeye Name: N'-[(E)-3-[(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]prop-2-enoyl]-4-nitro-benzohydrazide CAS Name: N'-[(E)-3-[(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]-1-oxoprop-2-enyl]-4-nitrobenzohydrazide IUPAC Name: N'-[(E)-3-[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]prop-2-enoyl]-4-nitrobenzohydrazide Traditional Name: N'-[(E)-3-[(2S)-5-ethoxy-2-methyl-coumaran-6-yl]acryloyl]-4-nitro-benzohydrazide Formula: C21H21N3O6 MolecularWeight: 411.40794

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1C=CC(=O)NNC(=O)C3=CC=C(C=C3)[N+](=O)[O-])OC(C2)C

Isomeric SMILES

CCOC1=CC2=C(C=C1/C=C/C(=O)NNC(=O)C3=CC=C(C=C3)[N+](=O)[O-])O[C@H](C2)C

InChI

InChI=1S/C21H21N3O6/c1-3-29-18-12-16-10-13(2)30-19(16)11-15(18)6-9-20(25)22-23-21(26)14-4-7-17(8-5-14)24(27)28/h4-9,11-13H,3,10H2,1-2H3,(H,22,25)(H,23,26)/b9-6+/t13-/m0/s1