6-(2-iodanylbutoxycarbonyl)naphthalene-2-carboxylic acid

Systemtic Name: 6-(2-iodanylbutoxycarbonyl)naphthalene-2-carboxylic acid Openeye Name: 6-(2-iodobutoxycarbonyl)naphthalene-2-carboxylic acid CAS Name: 6-[2-iodobutoxy(oxo)methyl]-2-naphthalenecarboxylic acid IUPAC Name: 6-(2-iodobutoxycarbonyl)naphthalene-2-carboxylic acid Traditional Name: 6-(2-iodobutoxycarbonyl)-2-naphthoic acid Formula: C16H15IO4 MolecularWeight: 398.19237

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(COC(=O)C1=CC2=C(C=C1)C=C(C=C2)C(=O)O)I

Isomeric SMILES

CCC(COC(=O)C1=CC2=C(C=C1)C=C(C=C2)C(=O)O)I

InChI

InChI=1S/C16H15IO4/c1-2-14(17)9-21-16(20)13-6-4-10-7-12(15(18)19)5-3-11(10)8-13/h3-8,14H,2,9H2,1H3,(H,18,19)