8-iodanyl-1-(2-methyl-4-nitro-phenyl)deca-1,6-diyn-4-ol

Systemtic Name: 8-iodanyl-1-(2-methyl-4-nitro-phenyl)deca-1,6-diyn-4-ol Openeye Name: 8-iodo-1-(2-methyl-4-nitro-phenyl)deca-1,6-diyn-4-ol CAS Name: 8-iodo-1-(2-methyl-4-nitrophenyl)-4-deca-1,6-diynol IUPAC Name: 8-iodo-1-(2-methyl-4-nitrophenyl)deca-1,6-diyn-4-ol Traditional Name: 8-iodo-1-(2-methyl-4-nitro-phenyl)deca-1,6-diyn-4-ol Formula: C17H18INO3 MolecularWeight: 411.23419

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C#CCC(CC#CC1=C(C=C(C=C1)[N+](=O)[O-])C)O)I

Isomeric SMILES

CCC(C#CCC(CC#CC1=C(C=C(C=C1)[N+](=O)[O-])C)O)I

InChI

InChI=1S/C17H18INO3/c1-3-15(18)7-5-9-17(20)8-4-6-14-10-11-16(19(21)22)12-13(14)2/h10-12,15,17,20H,3,8-9H2,1-2H3