N-ethanoyl-2-iodyl-3-octadecanoyl-benzamide

Systemtic Name: N-ethanoyl-2-iodyl-3-octadecanoyl-benzamide Openeye Name: N-acetyl-2-iodyl-3-octadecanoyl-benzamide CAS Name: N-acetyl-2-iodyl-3-(1-oxooctadecyl)benzamide IUPAC Name: N-acetyl-2-iodyl-3-octadecanoylbenzamide Traditional Name: N-acetyl-2-iodyl-3-stearoyl-benzamide Formula: C27H42INO5 MolecularWeight: 587.53055

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H42INO5/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21-25(31)23-19-18-20-24(26(23)28(33)34)27(32)29-22(2)30/h18-20H,3-17,21H2,1-2H3,(H,29,30,32)