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

Systemtic Name: 5-[3-(5-iodanylpent-1-ynyl)-4-methoxy-2-nitro-phenyl]pent-4-yn-1-ol Openeye Name: 5-[3-(5-iodopent-1-ynyl)-4-methoxy-2-nitro-phenyl]pent-4-yn-1-ol CAS Name: 5-[3-(5-iodopent-1-ynyl)-4-methoxy-2-nitrophenyl]-4-pentyn-1-ol IUPAC Name: 5-[3-(5-iodopent-1-ynyl)-4-methoxy-2-nitrophenyl]pent-4-yn-1-ol Traditional Name: 5-[3-(5-iodopent-1-ynyl)-4-methoxy-2-nitro-phenyl]pent-4-yn-1-ol Formula: C17H18INO4 MolecularWeight: 427.23359

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)C#CCCCO)[N+](=O)[O-])C#CCCCI

Isomeric SMILES

COC1=C(C(=C(C=C1)C#CCCCO)[N+](=O)[O-])C#CCCCI

InChI

InChI=1S/C17H18INO4/c1-23-16-11-10-14(8-4-3-7-13-20)17(19(21)22)15(16)9-5-2-6-12-18/h10-11,20H,2-3,6-7,12-13H2,1H3