3-nitro-6-(3-oxidanylpropyl)-2-phenylmethoxy-phenol

Systemtic Name: 3-nitro-6-(3-oxidanylpropyl)-2-phenylmethoxy-phenol Openeye Name: 2-benzyloxy-6-(3-hydroxypropyl)-3-nitro-phenol CAS Name: 6-(3-hydroxypropyl)-3-nitro-2-phenylmethoxyphenol IUPAC Name: 6-(3-hydroxypropyl)-3-nitro-2-phenylmethoxyphenol Traditional Name: 2-benzoxy-6-(3-hydroxypropyl)-3-nitro-phenol Formula: C16H17NO5 MolecularWeight: 303.30988

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C(C=CC(=C2O)CCCO)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)COC2=C(C=CC(=C2O)CCCO)[N+](=O)[O-]

InChI

InChI=1S/C16H17NO5/c18-10-4-7-13-8-9-14(17(20)21)16(15(13)19)22-11-12-5-2-1-3-6-12/h1-3,5-6,8-9,18-19H,4,7,10-11H2