N-[5-(4-nitrophenyl)sulfonyl-1,3-thiazol-2-yl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide

Systemtic Name: N-[5-(4-nitrophenyl)sulfonyl-1,3-thiazol-2-yl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide Openeye Name: N-[5-(4-nitrophenyl)sulfonylthiazol-2-yl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide CAS Name: N-[5-(4-nitrophenyl)sulfonyl-2-thiazolyl]-2,3-dihydro-1,4-benzodioxin-3-carboxamide IUPAC Name: N-[5-(4-nitrophenyl)sulfonyl-1,3-thiazol-2-yl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide Traditional Name: N-(5-nosylthiazol-2-yl)-2,3-dihydro-1,4-benzodioxin-3-carboxamide Formula: C18H13N3O7S2 MolecularWeight: 447.44172

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC=CC=C2O1)C(=O)NC3=NC=C(S3)S(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1C(OC2=CC=CC=C2O1)C(=O)NC3=NC=C(S3)S(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C18H13N3O7S2/c22-17(15-10-27-13-3-1-2-4-14(13)28-15)20-18-19-9-16(29-18)30(25,26)12-7-5-11(6-8-12)21(23)24/h1-9,15H,10H2,(H,19,20,22)