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

Systemtic Name: N-(5-chloranyl-6-methyl-1,3-benzothiazol-2-yl)-4-ethoxy-3-nitro-benzamide Openeye Name: N-(5-chloro-6-methyl-1,3-benzothiazol-2-yl)-4-ethoxy-3-nitro-benzamide CAS Name: N-(5-chloro-6-methyl-1,3-benzothiazol-2-yl)-4-ethoxy-3-nitrobenzamide IUPAC Name: N-(5-chloro-6-methyl-1,3-benzothiazol-2-yl)-4-ethoxy-3-nitrobenzamide Traditional Name: N-(5-chloro-6-methyl-1,3-benzothiazol-2-yl)-4-ethoxy-3-nitro-benzamide Formula: C17H14ClN3O4S MolecularWeight: 391.82876

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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)C)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C17H14ClN3O4S/c1-3-25-14-5-4-10(7-13(14)21(23)24)16(22)20-17-19-12-8-11(18)9(2)6-15(12)26-17/h4-8H,3H2,1-2H3,(H,19,20,22)