5-acetamido-N3-[6-azanyl-1-(4-methylpiperidin-1-yl)-1-oxidanylidene-hexan-2-yl]-2,4,6-tris(iodanyl)-N1-methyl-benzene-1,3-dicarboxamide

Systemtic Name: 5-acetamido-N3-[6-azanyl-1-(4-methylpiperidin-1-yl)-1-oxidanylidene-hexan-2-yl]-2,4,6-tris(iodanyl)-N1-methyl-benzene-1,3-dicarboxamide Openeye Name: 5-acetamido-N3-[5-amino-1-(4-methylpiperidine-1-carbonyl)pentyl]-2,4,6-triiodo-N1-methyl-benzene-1,3-dicarboxamide CAS Name: 5-acetamido-N3-[6-amino-1-(4-methyl-1-piperidinyl)-1-oxohexan-2-yl]-2,4,6-triiodo-N1-methylbenzene-1,3-dicarboxamide IUPAC Name: 5-acetamido-3-N-[6-amino-1-(4-methylpiperidin-1-yl)-1-oxohexan-2-yl]-2,4,6-triiodo-1-N-methylbenzene-1,3-dicarboxamide Traditional Name: 5-acetamido-N'-[5-amino-1-(4-methylpiperidine-1-carbonyl)pentyl]-2,4,6-triiodo-N-methyl-isophthalamide Formula: C23H32I3N5O4 MolecularWeight: 823.24469

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)C(CCCCN)NC(=O)C2=C(C(=C(C(=C2I)C(=O)NC)I)NC(=O)C)I

Isomeric SMILES

CC1CCN(CC1)C(=O)C(CCCCN)NC(=O)C2=C(C(=C(C(=C2I)C(=O)NC)I)NC(=O)C)I

InChI

InChI=1S/C23H32I3N5O4/c1-12-7-10-31(11-8-12)23(35)14(6-4-5-9-27)30-22(34)16-17(24)15(21(33)28-3)18(25)20(19(16)26)29-13(2)32/h12,14H,4-11,27H2,1-3H3,(H,28,33)(H,29,32)(H,30,34)