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

Systemtic Name: N'-[(E)-3-[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]prop-2-enoyl]-3-nitro-benzohydrazide Openeye Name: N'-[(E)-3-[(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]prop-2-enoyl]-3-nitro-benzohydrazide CAS Name: N'-[(E)-3-[(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]-1-oxoprop-2-enyl]-3-nitrobenzohydrazide IUPAC Name: N'-[(E)-3-[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]prop-2-enoyl]-3-nitrobenzohydrazide Traditional Name: N'-[(E)-3-[(2S)-5-ethoxy-2-methyl-coumaran-6-yl]acryloyl]-3-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(=CC=C3)[N+](=O)[O-])OC(C2)C

Isomeric SMILES

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

InChI

InChI=1S/C21H21N3O6/c1-3-29-18-12-16-9-13(2)30-19(16)11-14(18)7-8-20(25)22-23-21(26)15-5-4-6-17(10-15)24(27)28/h4-8,10-13H,3,9H2,1-2H3,(H,22,25)(H,23,26)/b8-7+/t13-/m0/s1