4-chloranyl-2-(propan-2-yloxymethyl)-1,3-benzothiazole-6-carboxylic acid

Systemtic Name: 4-chloranyl-2-(propan-2-yloxymethyl)-1,3-benzothiazole-6-carboxylic acid Openeye Name: 4-chloro-2-(isopropoxymethyl)-1,3-benzothiazole-6-carboxylic acid CAS Name: 4-chloro-2-(propan-2-yloxymethyl)-1,3-benzothiazole-6-carboxylic acid IUPAC Name: 4-chloro-2-(propan-2-yloxymethyl)-1,3-benzothiazole-6-carboxylic acid Traditional Name: 4-chloro-2-(isopropoxymethyl)-1,3-benzothiazole-6-carboxylic acid Formula: C12H12ClNO3S MolecularWeight: 285.74658

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCC1=NC2=C(S1)C=C(C=C2Cl)C(=O)O

Isomeric SMILES

CC(C)OCC1=NC2=C(S1)C=C(C=C2Cl)C(=O)O

InChI

InChI=1S/C12H12ClNO3S/c1-6(2)17-5-10-14-11-8(13)3-7(12(15)16)4-9(11)18-10/h3-4,6H,5H2,1-2H3,(H,15,16)