2-iodosyl-N-octadecanoyl-3-prop-2-ynyl-benzamide

Systemtic Name: 2-iodosyl-N-octadecanoyl-3-prop-2-ynyl-benzamide Openeye Name: 2-iodosyl-N-octadecanoyl-3-prop-2-ynyl-benzamide CAS Name: 2-iodosyl-N-(1-oxooctadecyl)-3-prop-2-ynylbenzamide IUPAC Name: 2-iodosyl-N-octadecanoyl-3-prop-2-ynylbenzamide Traditional Name: 2-iodosyl-3-propargyl-N-stearoyl-benzamide Formula: C28H42INO3 MolecularWeight: 567.54245

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)NC(=O)C1=C(C(=CC=C1)CC#C)I=O

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)NC(=O)C1=C(C(=CC=C1)CC#C)I=O

InChI

InChI=1S/C28H42INO3/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23-26(31)30-28(32)25-22-19-21-24(20-4-2)27(25)29-33/h2,19,21-22H,3,5-18,20,23H2,1H3,(H,30,31,32)