6-methylbenzo[e][1]benzothiole-4-carboxylic acid

Systemtic Name: 6-methylbenzo[e][1]benzothiole-4-carboxylic acid Openeye Name: 6-methylbenzo[e]benzothiophene-4-carboxylic acid CAS Name: 6-methyl-4-benzo[e][1]benzothiolecarboxylic acid IUPAC Name: 6-methylbenzo[e][1]benzothiole-4-carboxylic acid Traditional Name: 6-methylbenzo[e]benzothiophene-4-carboxylic acid Formula: C14H10O2S MolecularWeight: 242.293

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C3C=CSC3=C(C=C12)C(=O)O

Isomeric SMILES

CC1=CC=CC2=C3C=CSC3=C(C=C12)C(=O)O

InChI

InChI=1S/C14H10O2S/c1-8-3-2-4-9-10-5-6-17-13(10)12(14(15)16)7-11(8)9/h2-7H,1H3,(H,15,16)