2-(3-azanylpropyl)-1,3-benzothiazole-6-carboxylic acid

Systemtic Name: 2-(3-azanylpropyl)-1,3-benzothiazole-6-carboxylic acid Openeye Name: 2-(3-aminopropyl)-1,3-benzothiazole-6-carboxylic acid CAS Name: 2-(3-aminopropyl)-1,3-benzothiazole-6-carboxylic acid IUPAC Name: 2-(3-aminopropyl)-1,3-benzothiazole-6-carboxylic acid Traditional Name: 2-(3-aminopropyl)-1,3-benzothiazole-6-carboxylic acid Formula: C11H12N2O2S MolecularWeight: 236.29018

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1C(=O)O)SC(=N2)CCCN

Isomeric SMILES

C1=CC2=C(C=C1C(=O)O)SC(=N2)CCCN

InChI

InChI=1S/C11H12N2O2S/c12-5-1-2-10-13-8-4-3-7(11(14)15)6-9(8)16-10/h3-4,6H,1-2,5,12H2,(H,14,15)