5-[3-(3-iodanylpent-1-ynyl)-2-methyl-4-nitro-phenyl]pent-4-yn-1-ol

Systemtic Name: 5-[3-(3-iodanylpent-1-ynyl)-2-methyl-4-nitro-phenyl]pent-4-yn-1-ol Openeye Name: 5-[3-(3-iodopent-1-ynyl)-2-methyl-4-nitro-phenyl]pent-4-yn-1-ol CAS Name: 5-[3-(3-iodopent-1-ynyl)-2-methyl-4-nitrophenyl]-4-pentyn-1-ol IUPAC Name: 5-[3-(3-iodopent-1-ynyl)-2-methyl-4-nitrophenyl]pent-4-yn-1-ol Traditional Name: 5-[3-(3-iodopent-1-ynyl)-2-methyl-4-nitro-phenyl]pent-4-yn-1-ol Formula: C17H18INO3 MolecularWeight: 411.23419

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C#CC1=C(C=CC(=C1C)C#CCCCO)[N+](=O)[O-])I

Isomeric SMILES

CCC(C#CC1=C(C=CC(=C1C)C#CCCCO)[N+](=O)[O-])I

InChI

InChI=1S/C17H18INO3/c1-3-15(18)9-10-16-13(2)14(7-5-4-6-12-20)8-11-17(16)19(21)22/h8,11,15,20H,3-4,6,12H2,1-2H3