N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-4-nitro-3-oxidanyl-benzamide

Systemtic Name: N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-4-nitro-3-oxidanyl-benzamide Openeye Name: N-[4-(1,3-benzodioxol-5-yl)thiazol-2-yl]-3-hydroxy-4-nitro-benzamide CAS Name: N-[4-(1,3-benzodioxol-5-yl)-2-thiazolyl]-3-hydroxy-4-nitrobenzamide IUPAC Name: N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-3-hydroxy-4-nitrobenzamide Traditional Name: N-[4-(1,3-benzodioxol-5-yl)thiazol-2-yl]-3-hydroxy-4-nitro-benzamide Formula: C17H11N3O6S MolecularWeight: 385.35074

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=CSC(=N3)NC(=O)C4=CC(=C(C=C4)[N+](=O)[O-])O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=CSC(=N3)NC(=O)C4=CC(=C(C=C4)[N+](=O)[O-])O

InChI

InChI=1S/C17H11N3O6S/c21-13-5-10(1-3-12(13)20(23)24)16(22)19-17-18-11(7-27-17)9-2-4-14-15(6-9)26-8-25-14/h1-7,21H,8H2,(H,18,19,22)