4-chloranyl-2-pentyl-1,3-benzothiazole-6-carboxylate

Systemtic Name: 4-chloranyl-2-pentyl-1,3-benzothiazole-6-carboxylate Openeye Name: 4-chloro-2-pentyl-1,3-benzothiazole-6-carboxylate CAS Name: 4-chloro-2-pentyl-1,3-benzothiazole-6-carboxylate IUPAC Name: 4-chloro-2-pentyl-1,3-benzothiazole-6-carboxylate Traditional Name: 2-amyl-4-chloro-1,3-benzothiazole-6-carboxylate Formula: C13H13ClNO2S- MolecularWeight: 282.76582

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=NC2=C(S1)C=C(C=C2Cl)C(=O)[O-]

Isomeric SMILES

CCCCCC1=NC2=C(S1)C=C(C=C2Cl)C(=O)[O-]

InChI

InChI=1S/C13H14ClNO2S/c1-2-3-4-5-11-15-12-9(14)6-8(13(16)17)7-10(12)18-11/h6-7H,2-5H2,1H3,(H,16,17)/p-1