N-(6-chloranyl-3,4-dihydro-2H-thiochromen-4-yl)-6-nitro-2,3-dihydro-1,4-benzodioxine-7-carboxamide

Systemtic Name: N-(6-chloranyl-3,4-dihydro-2H-thiochromen-4-yl)-6-nitro-2,3-dihydro-1,4-benzodioxine-7-carboxamide Openeye Name: N-(6-chlorothiochroman-4-yl)-6-nitro-2,3-dihydro-1,4-benzodioxine-7-carboxamide CAS Name: N-(6-chloro-3,4-dihydro-2H-1-benzothiopyran-4-yl)-6-nitro-2,3-dihydro-1,4-benzodioxin-7-carboxamide IUPAC Name: N-(6-chloro-3,4-dihydro-2H-thiochromen-4-yl)-6-nitro-2,3-dihydro-1,4-benzodioxine-7-carboxamide Traditional Name: N-(6-chlorothiochroman-4-yl)-6-nitro-2,3-dihydro-1,4-benzodioxin-7-carboxamide Formula: C18H15ClN2O5S MolecularWeight: 406.8401

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC2=C(C1NC(=O)C3=CC4=C(C=C3[N+](=O)[O-])OCCO4)C=C(C=C2)Cl

Isomeric SMILES

C1CSC2=C(C1NC(=O)C3=CC4=C(C=C3[N+](=O)[O-])OCCO4)C=C(C=C2)Cl

InChI

InChI=1S/C18H15ClN2O5S/c19-10-1-2-17-11(7-10)13(3-6-27-17)20-18(22)12-8-15-16(26-5-4-25-15)9-14(12)21(23)24/h1-2,7-9,13H,3-6H2,(H,20,22)