2-iodosyl-3-octadecanoyl-naphthalene-1-carboxylic acid

Systemtic Name: 2-iodosyl-3-octadecanoyl-naphthalene-1-carboxylic acid Openeye Name: 2-iodosyl-3-octadecanoyl-naphthalene-1-carboxylic acid CAS Name: 2-iodosyl-3-(1-oxooctadecyl)-1-naphthalenecarboxylic acid IUPAC Name: 2-iodosyl-3-octadecanoylnaphthalene-1-carboxylic acid Traditional Name: 2-iodosyl-3-stearoyl-1-naphthoic acid Formula: C29H41IO4 MolecularWeight: 580.53791

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)C1=CC2=CC=CC=C2C(=C1I=O)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)C1=CC2=CC=CC=C2C(=C1I=O)C(=O)O

InChI

InChI=1S/C29H41IO4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-21-26(31)25-22-23-19-17-18-20-24(23)27(29(32)33)28(25)30-34/h17-20,22H,2-16,21H2,1H3,(H,32,33)