1-(2-nitro-5-phenylmethoxy-phenyl)hex-2-yn-1-ol

Systemtic Name: 1-(2-nitro-5-phenylmethoxy-phenyl)hex-2-yn-1-ol Openeye Name: 1-(5-benzyloxy-2-nitro-phenyl)hex-2-yn-1-ol CAS Name: 1-(2-nitro-5-phenylmethoxyphenyl)-2-hexyn-1-ol IUPAC Name: 1-(2-nitro-5-phenylmethoxyphenyl)hex-2-yn-1-ol Traditional Name: 1-(5-benzoxy-2-nitro-phenyl)hex-2-yn-1-ol Formula: C19H19NO4 MolecularWeight: 325.35846

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Descriptors Computed from Structure

Canonical SMILES:

CCCC#CC(C1=C(C=CC(=C1)OCC2=CC=CC=C2)[N+](=O)[O-])O

Isomeric SMILES

CCCC#CC(C1=C(C=CC(=C1)OCC2=CC=CC=C2)[N+](=O)[O-])O

InChI

InChI=1S/C19H19NO4/c1-2-3-5-10-19(21)17-13-16(11-12-18(17)20(22)23)24-14-15-8-6-4-7-9-15/h4,6-9,11-13,19,21H,2-3,14H2,1H3