2-(3-methoxycarbonylphenyl)ethanesulfinic acid

Systemtic Name: 2-(3-methoxycarbonylphenyl)ethanesulfinic acid Openeye Name: 2-(3-methoxycarbonylphenyl)ethanesulfinic acid CAS Name: 2-(3-methoxycarbonylphenyl)ethanesulfinic acid IUPAC Name: 2-(3-methoxycarbonylphenyl)ethanesulfinic acid Traditional Name: 2-(3-carbomethoxyphenyl)ethanesulfinic acid Formula: C10H12O4S MolecularWeight: 228.26488

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)CCS(=O)O

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)CCS(=O)O

InChI

InChI=1S/C10H12O4S/c1-14-10(11)9-4-2-3-8(7-9)5-6-15(12)13/h2-4,7H,5-6H2,1H3,(H,12,13)