N-[5-(1,3-benzothiazol-2-yl)-2-methoxy-phenyl]-2-(2-nitrophenoxy)ethanamide

Systemtic Name: N-[5-(1,3-benzothiazol-2-yl)-2-methoxy-phenyl]-2-(2-nitrophenoxy)ethanamide Openeye Name: N-[5-(1,3-benzothiazol-2-yl)-2-methoxy-phenyl]-2-(2-nitrophenoxy)acetamide CAS Name: N-[5-(1,3-benzothiazol-2-yl)-2-methoxyphenyl]-2-(2-nitrophenoxy)acetamide IUPAC Name: N-[5-(1,3-benzothiazol-2-yl)-2-methoxyphenyl]-2-(2-nitrophenoxy)acetamide Traditional Name: N-[5-(1,3-benzothiazol-2-yl)-2-methoxy-phenyl]-2-(2-nitrophenoxy)acetamide Formula: C22H17N3O5S MolecularWeight: 435.45248

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC3=CC=CC=C3S2)NC(=O)COC4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC3=CC=CC=C3S2)NC(=O)COC4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C22H17N3O5S/c1-29-18-11-10-14(22-24-15-6-2-5-9-20(15)31-22)12-16(18)23-21(26)13-30-19-8-4-3-7-17(19)25(27)28/h2-12H,13H2,1H3,(H,23,26)