N-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)-2-(4-propan-2-ylphenoxy)ethanamide

Systemtic Name: N-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)-2-(4-propan-2-ylphenoxy)ethanamide Openeye Name: 2-(4-isopropylphenoxy)-N-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)acetamide CAS Name: N-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)-2-(4-propan-2-ylphenoxy)acetamide IUPAC Name: N-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)-2-(4-propan-2-ylphenoxy)acetamide Traditional Name: 2-(4-isopropylphenoxy)-N-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)acetamide Formula: C19H19N3O5S MolecularWeight: 401.43626

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)OCC(=O)NC2=NC3=C(C=C(C=C3S2)[N+](=O)[O-])OC

Isomeric SMILES

CC(C)C1=CC=C(C=C1)OCC(=O)NC2=NC3=C(C=C(C=C3S2)[N+](=O)[O-])OC

InChI

InChI=1S/C19H19N3O5S/c1-11(2)12-4-6-14(7-5-12)27-10-17(23)20-19-21-18-15(26-3)8-13(22(24)25)9-16(18)28-19/h4-9,11H,10H2,1-3H3,(H,20,21,23)