3,4,5-trimethoxy-2-nitro-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)benzamide

Systemtic Name: 3,4,5-trimethoxy-2-nitro-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)benzamide Openeye Name: 3,4,5-trimethoxy-2-nitro-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)benzamide CAS Name: 3,4,5-trimethoxy-2-nitro-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)benzamide IUPAC Name: 3,4,5-trimethoxy-2-nitro-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)benzamide Traditional Name: 3,4,5-trimethoxy-2-nitro-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)benzamide Formula: C17H19N3O6S MolecularWeight: 393.41426

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C(=C1)C(=O)NC2=NC3=C(S2)CCCC3)[N+](=O)[O-])OC)OC

Isomeric SMILES

COC1=C(C(=C(C(=C1)C(=O)NC2=NC3=C(S2)CCCC3)[N+](=O)[O-])OC)OC

InChI

InChI=1S/C17H19N3O6S/c1-24-11-8-9(13(20(22)23)15(26-3)14(11)25-2)16(21)19-17-18-10-6-4-5-7-12(10)27-17/h8H,4-7H2,1-3H3,(H,18,19,21)