4-[3-nitro-5-(3-phenylprop-2-ynoxy)phenyl]oxan-4-ol

Systemtic Name: 4-[3-nitro-5-(3-phenylprop-2-ynoxy)phenyl]oxan-4-ol Openeye Name: 4-[3-nitro-5-(3-phenylprop-2-ynoxy)phenyl]tetrahydropyran-4-ol CAS Name: 4-[3-nitro-5-(3-phenylprop-2-ynoxy)phenyl]-4-oxanol IUPAC Name: 4-[3-nitro-5-(3-phenylprop-2-ynoxy)phenyl]oxan-4-ol Traditional Name: 4-[3-nitro-5-(3-phenylprop-2-ynoxy)phenyl]tetrahydropyran-4-ol Formula: C20H19NO5 MolecularWeight: 353.36856

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1(C2=CC(=CC(=C2)OCC#CC3=CC=CC=C3)[N+](=O)[O-])O

Isomeric SMILES

C1COCCC1(C2=CC(=CC(=C2)OCC#CC3=CC=CC=C3)[N+](=O)[O-])O

InChI

InChI=1S/C20H19NO5/c22-20(8-11-25-12-9-20)17-13-18(21(23)24)15-19(14-17)26-10-4-7-16-5-2-1-3-6-16/h1-3,5-6,13-15,22H,8-12H2