N-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,3-thiazol-2-yl]-4,5-dimethoxy-2-nitro-benzamide

Systemtic Name: N-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,3-thiazol-2-yl]-4,5-dimethoxy-2-nitro-benzamide Openeye Name: N-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)thiazol-2-yl]-4,5-dimethoxy-2-nitro-benzamide CAS Name: N-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-thiazolyl]-4,5-dimethoxy-2-nitrobenzamide IUPAC Name: N-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,3-thiazol-2-yl]-4,5-dimethoxy-2-nitrobenzamide Traditional Name: N-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)thiazol-2-yl]-4,5-dimethoxy-2-nitro-benzamide Formula: C20H17N3O7S MolecularWeight: 443.42988

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)NC2=NC(=CS2)C3=CC4=C(C=C3)OCCO4)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)NC2=NC(=CS2)C3=CC4=C(C=C3)OCCO4)[N+](=O)[O-])OC

InChI

InChI=1S/C20H17N3O7S/c1-27-16-8-12(14(23(25)26)9-17(16)28-2)19(24)22-20-21-13(10-31-20)11-3-4-15-18(7-11)30-6-5-29-15/h3-4,7-10H,5-6H2,1-2H3,(H,21,22,24)