2-(4-tert-butylphenoxy)-2-methyl-N-(6-nitro-1,3-benzothiazol-2-yl)propanamide

Systemtic Name: 2-(4-tert-butylphenoxy)-2-methyl-N-(6-nitro-1,3-benzothiazol-2-yl)propanamide Openeye Name: 2-(4-tert-butylphenoxy)-2-methyl-N-(6-nitro-1,3-benzothiazol-2-yl)propanamide CAS Name: 2-(4-tert-butylphenoxy)-2-methyl-N-(6-nitro-1,3-benzothiazol-2-yl)propanamide IUPAC Name: 2-(4-tert-butylphenoxy)-2-methyl-N-(6-nitro-1,3-benzothiazol-2-yl)propanamide Traditional Name: 2-(4-tert-butylphenoxy)-2-methyl-N-(6-nitro-1,3-benzothiazol-2-yl)propionamide Formula: C21H23N3O4S MolecularWeight: 413.49002

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23N3O4S/c1-20(2,3)13-6-9-15(10-7-13)28-21(4,5)18(25)23-19-22-16-11-8-14(24(26)27)12-17(16)29-19/h6-12H,1-5H3,(H,22,23,25)