N-(6-nitro-1,3-benzothiazol-2-yl)-2-(2,3,5-trimethylphenoxy)ethanamide

Systemtic Name: N-(6-nitro-1,3-benzothiazol-2-yl)-2-(2,3,5-trimethylphenoxy)ethanamide Openeye Name: N-(6-nitro-1,3-benzothiazol-2-yl)-2-(2,3,5-trimethylphenoxy)acetamide CAS Name: N-(6-nitro-1,3-benzothiazol-2-yl)-2-(2,3,5-trimethylphenoxy)acetamide IUPAC Name: N-(6-nitro-1,3-benzothiazol-2-yl)-2-(2,3,5-trimethylphenoxy)acetamide Traditional Name: N-(6-nitro-1,3-benzothiazol-2-yl)-2-(2,3,5-trimethylphenoxy)acetamide Formula: C18H17N3O4S MolecularWeight: 371.41028

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)OCC(=O)NC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-])C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)OCC(=O)NC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-])C)C

InChI

InChI=1S/C18H17N3O4S/c1-10-6-11(2)12(3)15(7-10)25-9-17(22)20-18-19-14-5-4-13(21(23)24)8-16(14)26-18/h4-8H,9H2,1-3H3,(H,19,20,22)