N-(6-chloranyl-1,3-benzothiazol-2-yl)-5-ethoxy-4-methoxy-2-nitro-benzamide

Systemtic Name: N-(6-chloranyl-1,3-benzothiazol-2-yl)-5-ethoxy-4-methoxy-2-nitro-benzamide Openeye Name: N-(6-chloro-1,3-benzothiazol-2-yl)-5-ethoxy-4-methoxy-2-nitro-benzamide CAS Name: N-(6-chloro-1,3-benzothiazol-2-yl)-5-ethoxy-4-methoxy-2-nitrobenzamide IUPAC Name: N-(6-chloro-1,3-benzothiazol-2-yl)-5-ethoxy-4-methoxy-2-nitrobenzamide Traditional Name: N-(6-chloro-1,3-benzothiazol-2-yl)-5-ethoxy-4-methoxy-2-nitro-benzamide Formula: C17H14ClN3O5S MolecularWeight: 407.82816

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)C(=O)NC2=NC3=C(S2)C=C(C=C3)Cl)[N+](=O)[O-])OC

Isomeric SMILES

CCOC1=C(C=C(C(=C1)C(=O)NC2=NC3=C(S2)C=C(C=C3)Cl)[N+](=O)[O-])OC

InChI

InChI=1S/C17H14ClN3O5S/c1-3-26-14-7-10(12(21(23)24)8-13(14)25-2)16(22)20-17-19-11-5-4-9(18)6-15(11)27-17/h4-8H,3H2,1-2H3,(H,19,20,22)