4-[(3-methoxycarbonylphenyl)methoxycarbonyl]benzenesulfonic acid

Systemtic Name: 4-[(3-methoxycarbonylphenyl)methoxycarbonyl]benzenesulfonic acid Openeye Name: 4-[(3-methoxycarbonylphenyl)methoxycarbonyl]benzenesulfonic acid CAS Name: 4-[(3-methoxycarbonylphenyl)methoxy-oxomethyl]benzenesulfonic acid IUPAC Name: 4-[(3-methoxycarbonylphenyl)methoxycarbonyl]benzenesulfonic acid Traditional Name: 4-(3-carbomethoxybenzyl)oxycarbonylbesylic acid Formula: C16H14O7S MolecularWeight: 350.34316

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)COC(=O)C2=CC=C(C=C2)S(=O)(=O)O

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)COC(=O)C2=CC=C(C=C2)S(=O)(=O)O

InChI

InChI=1S/C16H14O7S/c1-22-15(17)13-4-2-3-11(9-13)10-23-16(18)12-5-7-14(8-6-12)24(19,20)21/h2-9H,10H2,1H3,(H,19,20,21)