2-[4-(1,3-benzothiazol-2-yl)phenoxy]-N-(4-chloranyl-3-nitro-phenyl)ethanamide

Systemtic Name: 2-[4-(1,3-benzothiazol-2-yl)phenoxy]-N-(4-chloranyl-3-nitro-phenyl)ethanamide Openeye Name: 2-[4-(1,3-benzothiazol-2-yl)phenoxy]-N-(4-chloro-3-nitro-phenyl)acetamide CAS Name: 2-[4-(1,3-benzothiazol-2-yl)phenoxy]-N-(4-chloro-3-nitrophenyl)acetamide IUPAC Name: 2-[4-(1,3-benzothiazol-2-yl)phenoxy]-N-(4-chloro-3-nitrophenyl)acetamide Traditional Name: 2-[4-(1,3-benzothiazol-2-yl)phenoxy]-N-(4-chloro-3-nitro-phenyl)acetamide Formula: C21H14ClN3O4S MolecularWeight: 439.87156

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C3=CC=C(C=C3)OCC(=O)NC4=CC(=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)C3=CC=C(C=C3)OCC(=O)NC4=CC(=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C21H14ClN3O4S/c22-16-10-7-14(11-18(16)25(27)28)23-20(26)12-29-15-8-5-13(6-9-15)21-24-17-3-1-2-4-19(17)30-21/h1-11H,12H2,(H,23,26)