3-iodyl-5-octadecanoyl-naphthalene-2-carboxylic acid

Systemtic Name: 3-iodyl-5-octadecanoyl-naphthalene-2-carboxylic acid Openeye Name: 3-iodyl-5-octadecanoyl-naphthalene-2-carboxylic acid CAS Name: 3-iodyl-5-(1-oxooctadecyl)-2-naphthalenecarboxylic acid IUPAC Name: 3-iodyl-5-octadecanoylnaphthalene-2-carboxylic acid Traditional Name: 3-iodyl-5-stearoyl-2-naphthoic acid Formula: C29H41IO5 MolecularWeight: 596.53731

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)C1=CC=CC2=CC(=C(C=C21)I(=O)=O)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)C1=CC=CC2=CC(=C(C=C21)I(=O)=O)C(=O)O

InChI

InChI=1S/C29H41IO5/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-28(31)24-19-17-18-23-21-26(29(32)33)27(30(34)35)22-25(23)24/h17-19,21-22H,2-16,20H2,1H3,(H,32,33)