5-(3-methyl-1-benzothiophen-2-yl)-1,2-oxazole-3-carboxylic acid

Systemtic Name: 5-(3-methyl-1-benzothiophen-2-yl)-1,2-oxazole-3-carboxylic acid Openeye Name: 5-(3-methylbenzothiophen-2-yl)isoxazole-3-carboxylic acid CAS Name: 5-(3-methyl-1-benzothiophen-2-yl)-3-isoxazolecarboxylic acid IUPAC Name: 5-(3-methyl-1-benzothiophen-2-yl)-1,2-oxazole-3-carboxylic acid Traditional Name: 5-(3-methylbenzothiophen-2-yl)isoxazole-3-carboxylic acid Formula: C13H9NO3S MolecularWeight: 259.28046

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=CC=CC=C12)C3=CC(=NO3)C(=O)O

Isomeric SMILES

CC1=C(SC2=CC=CC=C12)C3=CC(=NO3)C(=O)O

InChI

InChI=1S/C13H9NO3S/c1-7-8-4-2-3-5-11(8)18-12(7)10-6-9(13(15)16)14-17-10/h2-6H,1H3,(H,15,16)