1-(4-methoxyphenyl)sulfonylazepane-2,3-dicarboxylic acid

Systemtic Name: 1-(4-methoxyphenyl)sulfonylazepane-2,3-dicarboxylic acid Openeye Name: 1-(4-methoxyphenyl)sulfonylazepane-2,3-dicarboxylic acid CAS Name: 1-(4-methoxyphenyl)sulfonylazepane-2,3-dicarboxylic acid IUPAC Name: 1-(4-methoxyphenyl)sulfonylazepane-2,3-dicarboxylic acid Traditional Name: 1-(4-methoxyphenyl)sulfonylazepane-2,3-dicarboxylic acid Formula: C15H19NO7S MolecularWeight: 357.37886

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCCCC(C2C(=O)O)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCCCC(C2C(=O)O)C(=O)O

InChI

InChI=1S/C15H19NO7S/c1-23-10-5-7-11(8-6-10)24(21,22)16-9-3-2-4-12(14(17)18)13(16)15(19)20/h5-8,12-13H,2-4,9H2,1H3,(H,17,18)(H,19,20)