1-[2-(3-methylbut-2-enoxy)-5-nitro-phenyl]prop-2-yn-1-ol

Systemtic Name: 1-[2-(3-methylbut-2-enoxy)-5-nitro-phenyl]prop-2-yn-1-ol Openeye Name: 1-[2-(3-methylbut-2-enoxy)-5-nitro-phenyl]prop-2-yn-1-ol CAS Name: 1-[2-(3-methylbut-2-enoxy)-5-nitrophenyl]-2-propyn-1-ol IUPAC Name: 1-[2-(3-methylbut-2-enoxy)-5-nitrophenyl]prop-2-yn-1-ol Traditional Name: 1-[2-(3-methylbut-2-enoxy)-5-nitro-phenyl]prop-2-yn-1-ol Formula: C14H15NO4 MolecularWeight: 261.2732

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCOC1=C(C=C(C=C1)[N+](=O)[O-])C(C#C)O)C

Isomeric SMILES

CC(=CCOC1=C(C=C(C=C1)[N+](=O)[O-])C(C#C)O)C

InChI

InChI=1S/C14H15NO4/c1-4-13(16)12-9-11(15(17)18)5-6-14(12)19-8-7-10(2)3/h1,5-7,9,13,16H,8H2,2-3H3